USER MOD reduce.3.24.130724 H: found=0, std=0, add=726, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 723 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 463 HIS HD1 : A 463 HIS ND1 : A 500 ZNZN :(H bumps) USER MOD NoAdj-H: A 465 HIS HE2 : A 465 HIS NE2 : A 500 ZNZN :(H bumps) USER MOD Set 1.1: B 5 DT C7 :methyl 150:sc= -6.84! (180deg=-6.84!) USER MOD Set 1.2: B 6 DT C7 :methyl -30:sc= -7.11! (180deg=-5.78!) USER MOD Set 1.3: B 7 DT C7 :methyl -30:sc= -3.21! (180deg=-6.35!) USER MOD Set 2.1: A 462 LYS NZ :NH3+ 166:sc= 1.15 (180deg=0) USER MOD Set 2.2: A 464 ASN : amide:sc= 1.12 K(o=2.3,f=-5.8) USER MOD Set 3.1: A 416 LYS NZ :NH3+ 136:sc= 1.01 (180deg=0.615) USER MOD Set 3.2: A 432 TYR OH : rot 165:sc= -0.031 USER MOD Single : A 412 TYR OH : rot -39:sc= 0.0376 USER MOD Single : A 417 TYR OH : rot 22:sc= 0.0771 USER MOD Single : A 419 GLN : amide:sc= -3.16 K(o=-3.2,f=-2.6!) USER MOD Single : A 420 LYS NZ :NH3+ 150:sc= -0.0565 (180deg=-0.657) USER MOD Single : A 423 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 425 ASN : amide:sc= -0.349 K(o=-0.35,f=-9!) USER MOD Single : A 427 TYR OH : rot 30:sc= 0 USER MOD Single : A 430 SER OG : rot -120:sc= 0.145 USER MOD Single : A 431 TYR OH : rot -166:sc= 1.11 USER MOD Single : A 433 LYS NZ :NH3+ 172:sc= -0.149 (180deg=-0.374) USER MOD Single : A 435 THR OG1 : rot 180:sc= -1.19 USER MOD Single : A 436 THR OG1 : rot 143:sc= -0.705! USER MOD Single : A 443 LYS NZ :NH3+ -161:sc= -0.278 (180deg=-1.04) USER MOD Single : A 444 HIS : no HE2:sc= 0.677 K(o=1.1,f=-7.7!) USER MOD Single : A 450 THR OG1 : rot -56:sc= 1.15 USER MOD Single : A 453 LYS NZ :NH3+ -116:sc= -1.24 (180deg=-2.89!) USER MOD Single : A 457 THR OG1 : rot 180:sc= 0 USER MOD Single : A 458 THR OG1 : rot 180:sc= 0 USER MOD Single : A 459 TYR OH : rot 180:sc= 0 USER MOD Single : B 3 DC O5' : rot 180:sc= -1.34 USER MOD Single : B 12 DA O3' : rot 180:sc= 0 USER MOD Single : C 21 DT C7 :methyl 150:sc= 0 (180deg=0) USER MOD Single : C 21 DT O5' : rot 180:sc= 0 USER MOD Single : C 24 DT C7 :methyl 150:sc= -1.26 (180deg=-1.26) USER MOD Single : C 30 DG O3' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N LEU A 407 5.146 7.873 1.956 1.00 0.00 N ATOM 2 CA LEU A 407 6.591 7.820 2.310 1.00 0.00 C ATOM 3 C LEU A 407 7.447 8.478 1.232 1.00 0.00 C ATOM 4 O LEU A 407 8.365 7.865 0.688 1.00 0.00 O ATOM 5 CB LEU A 407 7.011 6.356 2.504 1.00 0.00 C ATOM 6 CG LEU A 407 6.163 5.318 1.762 1.00 0.00 C ATOM 7 CD1 LEU A 407 7.051 4.274 1.101 1.00 0.00 C ATOM 8 CD2 LEU A 407 5.177 4.658 2.716 1.00 0.00 C ATOM 0 HA LEU A 407 6.745 8.372 3.237 1.00 0.00 H new ATOM 0 HB2 LEU A 407 8.047 6.249 2.183 1.00 0.00 H new ATOM 0 HB3 LEU A 407 6.982 6.127 3.569 1.00 0.00 H new ATOM 0 HG LEU A 407 5.598 5.828 0.982 1.00 0.00 H new ATOM 0 HD11 LEU A 407 6.430 3.546 0.579 1.00 0.00 H new ATOM 0 HD12 LEU A 407 7.716 4.761 0.388 1.00 0.00 H new ATOM 0 HD13 LEU A 407 7.644 3.766 1.862 1.00 0.00 H new ATOM 0 HD21 LEU A 407 4.582 3.923 2.173 1.00 0.00 H new ATOM 0 HD22 LEU A 407 5.723 4.162 3.518 1.00 0.00 H new ATOM 0 HD23 LEU A 407 4.519 5.416 3.140 1.00 0.00 H new ATOM 20 N LEU A 408 7.139 9.737 0.934 1.00 0.00 N ATOM 21 CA LEU A 408 7.872 10.496 -0.074 1.00 0.00 C ATOM 22 C LEU A 408 7.662 9.922 -1.473 1.00 0.00 C ATOM 23 O LEU A 408 6.825 10.414 -2.231 1.00 0.00 O ATOM 24 CB LEU A 408 9.366 10.536 0.268 1.00 0.00 C ATOM 25 CG LEU A 408 9.826 11.807 0.986 1.00 0.00 C ATOM 26 CD1 LEU A 408 10.799 11.469 2.105 1.00 0.00 C ATOM 27 CD2 LEU A 408 10.461 12.777 -0.001 1.00 0.00 C ATOM 0 H LEU A 408 6.382 10.256 1.379 1.00 0.00 H new ATOM 0 HA LEU A 408 7.481 11.513 -0.071 1.00 0.00 H new ATOM 0 HB2 LEU A 408 9.604 9.676 0.893 1.00 0.00 H new ATOM 0 HB3 LEU A 408 9.938 10.429 -0.653 1.00 0.00 H new ATOM 0 HG LEU A 408 8.952 12.287 1.427 1.00 0.00 H new ATOM 0 HD11 LEU A 408 11.114 12.386 2.603 1.00 0.00 H new ATOM 0 HD12 LEU A 408 10.311 10.814 2.826 1.00 0.00 H new ATOM 0 HD13 LEU A 408 11.671 10.964 1.689 1.00 0.00 H new ATOM 0 HD21 LEU A 408 10.782 13.675 0.527 1.00 0.00 H new ATOM 0 HD22 LEU A 408 11.323 12.305 -0.472 1.00 0.00 H new ATOM 0 HD23 LEU A 408 9.733 13.047 -0.766 1.00 0.00 H new ATOM 39 N ASP A 409 8.438 8.897 -1.822 1.00 0.00 N ATOM 40 CA ASP A 409 8.339 8.280 -3.146 1.00 0.00 C ATOM 41 C ASP A 409 8.829 9.254 -4.201 1.00 0.00 C ATOM 42 O ASP A 409 8.080 9.646 -5.099 1.00 0.00 O ATOM 43 CB ASP A 409 6.898 7.857 -3.434 1.00 0.00 C ATOM 44 CG ASP A 409 6.660 6.387 -3.153 1.00 0.00 C ATOM 45 OD1 ASP A 409 7.293 5.544 -3.824 1.00 0.00 O ATOM 46 OD2 ASP A 409 5.841 6.078 -2.261 1.00 0.00 O ATOM 0 H ASP A 409 9.139 8.477 -1.211 1.00 0.00 H new ATOM 0 HA ASP A 409 8.965 7.388 -3.169 1.00 0.00 H new ATOM 0 HB2 ASP A 409 6.218 8.455 -2.827 1.00 0.00 H new ATOM 0 HB3 ASP A 409 6.662 8.068 -4.477 1.00 0.00 H new ATOM 51 N ASP A 410 10.096 9.657 -4.067 1.00 0.00 N ATOM 52 CA ASP A 410 10.710 10.611 -4.980 1.00 0.00 C ATOM 53 C ASP A 410 9.657 11.624 -5.399 1.00 0.00 C ATOM 54 O ASP A 410 9.291 12.504 -4.619 1.00 0.00 O ATOM 55 CB ASP A 410 11.316 9.887 -6.190 1.00 0.00 C ATOM 56 CG ASP A 410 11.895 10.846 -7.212 1.00 0.00 C ATOM 57 OD1 ASP A 410 12.970 11.423 -6.943 1.00 0.00 O ATOM 58 OD2 ASP A 410 11.274 11.020 -8.282 1.00 0.00 O ATOM 0 H ASP A 410 10.717 9.331 -3.326 1.00 0.00 H new ATOM 0 HA ASP A 410 11.527 11.134 -4.483 1.00 0.00 H new ATOM 0 HB2 ASP A 410 12.098 9.209 -5.849 1.00 0.00 H new ATOM 0 HB3 ASP A 410 10.549 9.275 -6.665 1.00 0.00 H new ATOM 63 N GLY A 411 9.134 11.475 -6.602 1.00 0.00 N ATOM 64 CA GLY A 411 8.094 12.346 -7.073 1.00 0.00 C ATOM 65 C GLY A 411 7.148 11.540 -7.925 1.00 0.00 C ATOM 66 O GLY A 411 6.498 12.063 -8.829 1.00 0.00 O ATOM 0 H GLY A 411 9.419 10.755 -7.266 1.00 0.00 H new ATOM 0 HA2 GLY A 411 7.562 12.791 -6.232 1.00 0.00 H new ATOM 0 HA3 GLY A 411 8.519 13.167 -7.651 1.00 0.00 H new ATOM 70 N TYR A 412 7.094 10.237 -7.629 1.00 0.00 N ATOM 71 CA TYR A 412 6.239 9.328 -8.378 1.00 0.00 C ATOM 72 C TYR A 412 4.850 9.261 -7.754 1.00 0.00 C ATOM 73 O TYR A 412 4.684 9.491 -6.557 1.00 0.00 O ATOM 74 CB TYR A 412 6.879 7.937 -8.451 1.00 0.00 C ATOM 75 CG TYR A 412 7.489 7.599 -9.799 1.00 0.00 C ATOM 76 CD1 TYR A 412 7.920 8.594 -10.670 1.00 0.00 C ATOM 77 CD2 TYR A 412 7.648 6.276 -10.193 1.00 0.00 C ATOM 78 CE1 TYR A 412 8.488 8.280 -11.890 1.00 0.00 C ATOM 79 CE2 TYR A 412 8.214 5.955 -11.411 1.00 0.00 C ATOM 80 CZ TYR A 412 8.634 6.960 -12.256 1.00 0.00 C ATOM 81 OH TYR A 412 9.199 6.643 -13.469 1.00 0.00 O ATOM 0 H TYR A 412 7.630 9.797 -6.881 1.00 0.00 H new ATOM 0 HA TYR A 412 6.130 9.707 -9.394 1.00 0.00 H new ATOM 0 HB2 TYR A 412 7.653 7.866 -7.687 1.00 0.00 H new ATOM 0 HB3 TYR A 412 6.123 7.189 -8.210 1.00 0.00 H new ATOM 0 HD1 TYR A 412 7.809 9.631 -10.388 1.00 0.00 H new ATOM 0 HD2 TYR A 412 7.323 5.484 -9.534 1.00 0.00 H new ATOM 0 HE1 TYR A 412 8.816 9.066 -12.554 1.00 0.00 H new ATOM 0 HE2 TYR A 412 8.327 4.921 -11.700 1.00 0.00 H new ATOM 0 HH TYR A 412 8.889 7.276 -14.150 1.00 0.00 H new ATOM 91 N ARG A 413 3.854 8.968 -8.579 1.00 0.00 N ATOM 92 CA ARG A 413 2.474 8.892 -8.116 1.00 0.00 C ATOM 93 C ARG A 413 2.138 7.498 -7.602 1.00 0.00 C ATOM 94 O ARG A 413 2.115 6.532 -8.363 1.00 0.00 O ATOM 95 CB ARG A 413 1.526 9.276 -9.255 1.00 0.00 C ATOM 96 CG ARG A 413 0.085 9.476 -8.817 1.00 0.00 C ATOM 97 CD ARG A 413 -0.861 9.458 -10.007 1.00 0.00 C ATOM 98 NE ARG A 413 -1.856 10.525 -9.936 1.00 0.00 N ATOM 99 CZ ARG A 413 -1.645 11.769 -10.365 1.00 0.00 C ATOM 100 NH1 ARG A 413 -0.468 12.114 -10.873 1.00 0.00 N ATOM 101 NH2 ARG A 413 -2.612 12.670 -10.283 1.00 0.00 N ATOM 0 H ARG A 413 3.976 8.779 -9.574 1.00 0.00 H new ATOM 0 HA ARG A 413 2.352 9.591 -7.289 1.00 0.00 H new ATOM 0 HB2 ARG A 413 1.885 10.195 -9.719 1.00 0.00 H new ATOM 0 HB3 ARG A 413 1.559 8.499 -10.019 1.00 0.00 H new ATOM 0 HG2 ARG A 413 -0.196 8.692 -8.114 1.00 0.00 H new ATOM 0 HG3 ARG A 413 -0.009 10.425 -8.289 1.00 0.00 H new ATOM 0 HD2 ARG A 413 -0.286 9.560 -10.928 1.00 0.00 H new ATOM 0 HD3 ARG A 413 -1.367 8.494 -10.052 1.00 0.00 H new ATOM 0 HE ARG A 413 -2.767 10.305 -9.534 1.00 0.00 H new ATOM 0 HH11 ARG A 413 0.282 11.425 -10.937 1.00 0.00 H new ATOM 0 HH12 ARG A 413 -0.313 13.068 -11.200 1.00 0.00 H new ATOM 0 HH21 ARG A 413 -3.518 12.412 -9.892 1.00 0.00 H new ATOM 0 HH22 ARG A 413 -2.451 13.622 -10.611 1.00 0.00 H new ATOM 115 N TRP A 414 1.882 7.400 -6.299 1.00 0.00 N ATOM 116 CA TRP A 414 1.548 6.124 -5.680 1.00 0.00 C ATOM 117 C TRP A 414 0.218 6.200 -4.944 1.00 0.00 C ATOM 118 O TRP A 414 -0.109 7.215 -4.329 1.00 0.00 O ATOM 119 CB TRP A 414 2.640 5.707 -4.696 1.00 0.00 C ATOM 120 CG TRP A 414 4.018 5.743 -5.275 1.00 0.00 C ATOM 121 CD1 TRP A 414 4.815 6.838 -5.432 1.00 0.00 C ATOM 122 CD2 TRP A 414 4.760 4.627 -5.774 1.00 0.00 C ATOM 123 NE1 TRP A 414 6.019 6.472 -5.986 1.00 0.00 N ATOM 124 CE2 TRP A 414 6.007 5.116 -6.211 1.00 0.00 C ATOM 125 CE3 TRP A 414 4.491 3.261 -5.888 1.00 0.00 C ATOM 126 CZ2 TRP A 414 6.980 4.278 -6.755 1.00 0.00 C ATOM 127 CZ3 TRP A 414 5.455 2.435 -6.430 1.00 0.00 C ATOM 128 CH2 TRP A 414 6.685 2.946 -6.856 1.00 0.00 C ATOM 0 H TRP A 414 1.900 8.190 -5.654 1.00 0.00 H new ATOM 0 HA TRP A 414 1.469 5.384 -6.476 1.00 0.00 H new ATOM 0 HB2 TRP A 414 2.604 6.364 -3.827 1.00 0.00 H new ATOM 0 HB3 TRP A 414 2.431 4.698 -4.342 1.00 0.00 H new ATOM 0 HD1 TRP A 414 4.540 7.847 -5.161 1.00 0.00 H new ATOM 0 HE1 TRP A 414 6.793 7.102 -6.195 1.00 0.00 H new ATOM 0 HE3 TRP A 414 3.545 2.858 -5.558 1.00 0.00 H new ATOM 0 HZ2 TRP A 414 7.932 4.667 -7.085 1.00 0.00 H new ATOM 0 HZ3 TRP A 414 5.256 1.378 -6.527 1.00 0.00 H new ATOM 0 HH2 TRP A 414 7.419 2.273 -7.274 1.00 0.00 H new ATOM 139 N ARG A 415 -0.538 5.109 -4.996 1.00 0.00 N ATOM 140 CA ARG A 415 -1.824 5.041 -4.317 1.00 0.00 C ATOM 141 C ARG A 415 -1.797 3.967 -3.238 1.00 0.00 C ATOM 142 O ARG A 415 -2.011 2.787 -3.520 1.00 0.00 O ATOM 143 CB ARG A 415 -2.949 4.750 -5.317 1.00 0.00 C ATOM 144 CG ARG A 415 -4.285 4.455 -4.650 1.00 0.00 C ATOM 145 CD ARG A 415 -5.395 4.242 -5.667 1.00 0.00 C ATOM 146 NE ARG A 415 -5.716 2.826 -5.838 1.00 0.00 N ATOM 147 CZ ARG A 415 -6.886 2.380 -6.293 1.00 0.00 C ATOM 148 NH1 ARG A 415 -7.844 3.231 -6.634 1.00 0.00 N ATOM 149 NH2 ARG A 415 -7.095 1.075 -6.411 1.00 0.00 N ATOM 0 H ARG A 415 -0.282 4.261 -5.501 1.00 0.00 H new ATOM 0 HA ARG A 415 -2.014 6.007 -3.850 1.00 0.00 H new ATOM 0 HB2 ARG A 415 -3.064 5.605 -5.983 1.00 0.00 H new ATOM 0 HB3 ARG A 415 -2.664 3.900 -5.937 1.00 0.00 H new ATOM 0 HG2 ARG A 415 -4.190 3.567 -4.026 1.00 0.00 H new ATOM 0 HG3 ARG A 415 -4.551 5.281 -3.991 1.00 0.00 H new ATOM 0 HD2 ARG A 415 -6.287 4.780 -5.348 1.00 0.00 H new ATOM 0 HD3 ARG A 415 -5.094 4.664 -6.626 1.00 0.00 H new ATOM 0 HE ARG A 415 -5.002 2.139 -5.595 1.00 0.00 H new ATOM 0 HH11 ARG A 415 -7.688 4.235 -6.549 1.00 0.00 H new ATOM 0 HH12 ARG A 415 -8.737 2.881 -6.982 1.00 0.00 H new ATOM 0 HH21 ARG A 415 -6.361 0.416 -6.154 1.00 0.00 H new ATOM 0 HH22 ARG A 415 -7.990 0.731 -6.759 1.00 0.00 H new ATOM 163 N LYS A 416 -1.536 4.375 -1.999 1.00 0.00 N ATOM 164 CA LYS A 416 -1.488 3.435 -0.886 1.00 0.00 C ATOM 165 C LYS A 416 -2.762 2.595 -0.855 1.00 0.00 C ATOM 166 O LYS A 416 -3.804 3.027 -1.349 1.00 0.00 O ATOM 167 CB LYS A 416 -1.293 4.181 0.438 1.00 0.00 C ATOM 168 CG LYS A 416 -2.541 4.867 0.965 1.00 0.00 C ATOM 169 CD LYS A 416 -2.310 5.439 2.356 1.00 0.00 C ATOM 170 CE LYS A 416 -1.177 6.459 2.362 1.00 0.00 C ATOM 171 NZ LYS A 416 -0.613 6.658 3.725 1.00 0.00 N ATOM 0 H LYS A 416 -1.355 5.346 -1.742 1.00 0.00 H new ATOM 0 HA LYS A 416 -0.638 2.767 -1.025 1.00 0.00 H new ATOM 0 HB2 LYS A 416 -0.937 3.475 1.189 1.00 0.00 H new ATOM 0 HB3 LYS A 416 -0.511 4.929 0.307 1.00 0.00 H new ATOM 0 HG2 LYS A 416 -2.834 5.666 0.285 1.00 0.00 H new ATOM 0 HG3 LYS A 416 -3.366 4.155 0.994 1.00 0.00 H new ATOM 0 HD2 LYS A 416 -3.226 5.910 2.713 1.00 0.00 H new ATOM 0 HD3 LYS A 416 -2.076 4.630 3.048 1.00 0.00 H new ATOM 0 HE2 LYS A 416 -0.387 6.128 1.688 1.00 0.00 H new ATOM 0 HE3 LYS A 416 -1.544 7.411 1.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 416 0.425 6.676 3.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 416 -0.956 7.559 4.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 416 -0.914 5.877 4.343 1.00 0.00 H new ATOM 185 N TYR A 417 -2.681 1.396 -0.291 1.00 0.00 N ATOM 186 CA TYR A 417 -3.848 0.529 -0.236 1.00 0.00 C ATOM 187 C TYR A 417 -3.673 -0.638 0.733 1.00 0.00 C ATOM 188 O TYR A 417 -2.665 -1.347 0.707 1.00 0.00 O ATOM 189 CB TYR A 417 -4.172 -0.004 -1.640 1.00 0.00 C ATOM 190 CG TYR A 417 -3.400 -1.252 -2.023 1.00 0.00 C ATOM 191 CD1 TYR A 417 -3.838 -2.511 -1.630 1.00 0.00 C ATOM 192 CD2 TYR A 417 -2.233 -1.170 -2.771 1.00 0.00 C ATOM 193 CE1 TYR A 417 -3.134 -3.650 -1.971 1.00 0.00 C ATOM 194 CE2 TYR A 417 -1.523 -2.307 -3.116 1.00 0.00 C ATOM 195 CZ TYR A 417 -1.978 -3.544 -2.713 1.00 0.00 C ATOM 196 OH TYR A 417 -1.275 -4.676 -3.053 1.00 0.00 O ATOM 0 H TYR A 417 -1.835 1.008 0.127 1.00 0.00 H new ATOM 0 HA TYR A 417 -4.676 1.133 0.136 1.00 0.00 H new ATOM 0 HB2 TYR A 417 -5.239 -0.218 -1.698 1.00 0.00 H new ATOM 0 HB3 TYR A 417 -3.963 0.778 -2.371 1.00 0.00 H new ATOM 0 HD1 TYR A 417 -4.744 -2.601 -1.048 1.00 0.00 H new ATOM 0 HD2 TYR A 417 -1.873 -0.203 -3.089 1.00 0.00 H new ATOM 0 HE1 TYR A 417 -3.489 -4.620 -1.657 1.00 0.00 H new ATOM 0 HE2 TYR A 417 -0.617 -2.225 -3.698 1.00 0.00 H new ATOM 0 HH TYR A 417 -1.868 -5.455 -3.009 1.00 0.00 H new ATOM 206 N GLY A 418 -4.688 -0.837 1.564 1.00 0.00 N ATOM 207 CA GLY A 418 -4.678 -1.931 2.513 1.00 0.00 C ATOM 208 C GLY A 418 -4.164 -1.556 3.889 1.00 0.00 C ATOM 209 O GLY A 418 -3.692 -0.442 4.114 1.00 0.00 O ATOM 0 H GLY A 418 -5.524 -0.254 1.597 1.00 0.00 H new ATOM 0 HA2 GLY A 418 -5.691 -2.322 2.610 1.00 0.00 H new ATOM 0 HA3 GLY A 418 -4.062 -2.737 2.115 1.00 0.00 H new ATOM 213 N GLN A 419 -4.261 -2.514 4.808 1.00 0.00 N ATOM 214 CA GLN A 419 -3.815 -2.337 6.183 1.00 0.00 C ATOM 215 C GLN A 419 -3.929 -3.659 6.928 1.00 0.00 C ATOM 216 O GLN A 419 -5.000 -4.263 6.974 1.00 0.00 O ATOM 217 CB GLN A 419 -4.647 -1.261 6.883 1.00 0.00 C ATOM 218 CG GLN A 419 -4.240 -1.022 8.328 1.00 0.00 C ATOM 219 CD GLN A 419 -3.158 0.033 8.462 1.00 0.00 C ATOM 220 OE1 GLN A 419 -1.977 -0.242 8.260 1.00 0.00 O ATOM 221 NE2 GLN A 419 -3.562 1.251 8.807 1.00 0.00 N ATOM 0 H GLN A 419 -4.652 -3.436 4.617 1.00 0.00 H new ATOM 0 HA GLN A 419 -2.774 -2.014 6.180 1.00 0.00 H new ATOM 0 HB2 GLN A 419 -4.557 -0.326 6.329 1.00 0.00 H new ATOM 0 HB3 GLN A 419 -5.698 -1.549 6.853 1.00 0.00 H new ATOM 0 HG2 GLN A 419 -5.114 -0.715 8.902 1.00 0.00 H new ATOM 0 HG3 GLN A 419 -3.886 -1.957 8.761 1.00 0.00 H new ATOM 0 HE21 GLN A 419 -4.553 1.434 8.965 1.00 0.00 H new ATOM 0 HE22 GLN A 419 -2.881 2.003 8.914 1.00 0.00 H new ATOM 230 N LYS A 420 -2.821 -4.117 7.494 1.00 0.00 N ATOM 231 CA LYS A 420 -2.800 -5.382 8.216 1.00 0.00 C ATOM 232 C LYS A 420 -1.479 -5.537 8.965 1.00 0.00 C ATOM 233 O LYS A 420 -0.425 -5.175 8.450 1.00 0.00 O ATOM 234 CB LYS A 420 -3.005 -6.537 7.223 1.00 0.00 C ATOM 235 CG LYS A 420 -2.466 -7.884 7.689 1.00 0.00 C ATOM 236 CD LYS A 420 -3.536 -8.964 7.648 1.00 0.00 C ATOM 237 CE LYS A 420 -3.795 -9.438 6.228 1.00 0.00 C ATOM 238 NZ LYS A 420 -2.535 -9.814 5.529 1.00 0.00 N ATOM 0 H LYS A 420 -1.924 -3.631 7.467 1.00 0.00 H new ATOM 0 HA LYS A 420 -3.607 -5.399 8.948 1.00 0.00 H new ATOM 0 HB2 LYS A 420 -4.071 -6.639 7.021 1.00 0.00 H new ATOM 0 HB3 LYS A 420 -2.525 -6.276 6.280 1.00 0.00 H new ATOM 0 HG2 LYS A 420 -1.628 -8.178 7.058 1.00 0.00 H new ATOM 0 HG3 LYS A 420 -2.082 -7.790 8.705 1.00 0.00 H new ATOM 0 HD2 LYS A 420 -3.226 -9.808 8.264 1.00 0.00 H new ATOM 0 HD3 LYS A 420 -4.460 -8.578 8.078 1.00 0.00 H new ATOM 0 HE2 LYS A 420 -4.468 -10.295 6.249 1.00 0.00 H new ATOM 0 HE3 LYS A 420 -4.299 -8.650 5.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 420 -2.734 -10.561 4.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 420 -2.147 -8.981 5.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 420 -1.844 -10.163 6.223 1.00 0.00 H new ATOM 252 N VAL A 421 -1.539 -6.077 10.178 1.00 0.00 N ATOM 253 CA VAL A 421 -0.334 -6.272 10.975 1.00 0.00 C ATOM 254 C VAL A 421 0.159 -7.709 10.884 1.00 0.00 C ATOM 255 O VAL A 421 -0.625 -8.639 10.701 1.00 0.00 O ATOM 256 CB VAL A 421 -0.552 -5.893 12.461 1.00 0.00 C ATOM 257 CG1 VAL A 421 -1.451 -4.673 12.583 1.00 0.00 C ATOM 258 CG2 VAL A 421 -1.123 -7.064 13.252 1.00 0.00 C ATOM 0 H VAL A 421 -2.401 -6.385 10.627 1.00 0.00 H new ATOM 0 HA VAL A 421 0.423 -5.606 10.560 1.00 0.00 H new ATOM 0 HB VAL A 421 0.421 -5.645 12.886 1.00 0.00 H new ATOM 0 HG11 VAL A 421 -1.589 -4.427 13.636 1.00 0.00 H new ATOM 0 HG12 VAL A 421 -0.990 -3.829 12.070 1.00 0.00 H new ATOM 0 HG13 VAL A 421 -2.419 -4.888 12.131 1.00 0.00 H new ATOM 0 HG21 VAL A 421 -1.265 -6.767 14.291 1.00 0.00 H new ATOM 0 HG22 VAL A 421 -2.082 -7.359 12.825 1.00 0.00 H new ATOM 0 HG23 VAL A 421 -0.432 -7.905 13.207 1.00 0.00 H new ATOM 268 N VAL A 422 1.467 -7.880 11.023 1.00 0.00 N ATOM 269 CA VAL A 422 2.074 -9.201 10.969 1.00 0.00 C ATOM 270 C VAL A 422 2.824 -9.496 12.258 1.00 0.00 C ATOM 271 O VAL A 422 3.383 -8.582 12.886 1.00 0.00 O ATOM 272 CB VAL A 422 3.049 -9.337 9.779 1.00 0.00 C ATOM 273 CG1 VAL A 422 2.318 -9.838 8.545 1.00 0.00 C ATOM 274 CG2 VAL A 422 3.749 -8.014 9.495 1.00 0.00 C ATOM 0 H VAL A 422 2.128 -7.118 11.174 1.00 0.00 H new ATOM 0 HA VAL A 422 1.264 -9.918 10.838 1.00 0.00 H new ATOM 0 HB VAL A 422 3.812 -10.069 10.045 1.00 0.00 H new ATOM 0 HG11 VAL A 422 3.021 -9.928 7.717 1.00 0.00 H new ATOM 0 HG12 VAL A 422 1.877 -10.813 8.754 1.00 0.00 H new ATOM 0 HG13 VAL A 422 1.530 -9.134 8.278 1.00 0.00 H new ATOM 0 HG21 VAL A 422 4.430 -8.136 8.653 1.00 0.00 H new ATOM 0 HG22 VAL A 422 3.006 -7.254 9.254 1.00 0.00 H new ATOM 0 HG23 VAL A 422 4.312 -7.704 10.375 1.00 0.00 H new ATOM 284 N LYS A 423 2.827 -10.775 12.650 1.00 0.00 N ATOM 285 CA LYS A 423 3.501 -11.214 13.863 1.00 0.00 C ATOM 286 C LYS A 423 5.007 -11.248 13.650 1.00 0.00 C ATOM 287 O LYS A 423 5.488 -11.007 12.544 1.00 0.00 O ATOM 288 CB LYS A 423 3.002 -12.603 14.274 1.00 0.00 C ATOM 289 CG LYS A 423 1.646 -12.588 14.966 1.00 0.00 C ATOM 290 CD LYS A 423 0.519 -12.275 13.994 1.00 0.00 C ATOM 291 CE LYS A 423 0.303 -13.405 13.000 1.00 0.00 C ATOM 292 NZ LYS A 423 -0.057 -12.898 11.646 1.00 0.00 N ATOM 0 H LYS A 423 2.364 -11.525 12.136 1.00 0.00 H new ATOM 0 HA LYS A 423 3.274 -10.505 14.659 1.00 0.00 H new ATOM 0 HB2 LYS A 423 2.940 -13.234 13.387 1.00 0.00 H new ATOM 0 HB3 LYS A 423 3.734 -13.060 14.940 1.00 0.00 H new ATOM 0 HG2 LYS A 423 1.465 -13.556 15.432 1.00 0.00 H new ATOM 0 HG3 LYS A 423 1.654 -11.846 15.765 1.00 0.00 H new ATOM 0 HD2 LYS A 423 -0.402 -12.098 14.550 1.00 0.00 H new ATOM 0 HD3 LYS A 423 0.748 -11.355 13.455 1.00 0.00 H new ATOM 0 HE2 LYS A 423 1.210 -14.006 12.932 1.00 0.00 H new ATOM 0 HE3 LYS A 423 -0.488 -14.061 13.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 -0.195 -13.701 11.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 -0.936 -12.346 11.705 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 0.709 -12.293 11.287 1.00 0.00 H new ATOM 306 N GLY A 424 5.754 -11.520 14.717 1.00 0.00 N ATOM 307 CA GLY A 424 7.203 -11.542 14.613 1.00 0.00 C ATOM 308 C GLY A 424 7.766 -10.149 14.383 1.00 0.00 C ATOM 309 O GLY A 424 8.974 -9.928 14.480 1.00 0.00 O ATOM 0 H GLY A 424 5.385 -11.724 15.646 1.00 0.00 H new ATOM 0 HA2 GLY A 424 7.628 -11.961 15.525 1.00 0.00 H new ATOM 0 HA3 GLY A 424 7.500 -12.196 13.793 1.00 0.00 H new ATOM 313 N ASN A 425 6.871 -9.213 14.080 1.00 0.00 N ATOM 314 CA ASN A 425 7.220 -7.828 13.832 1.00 0.00 C ATOM 315 C ASN A 425 5.961 -6.984 14.013 1.00 0.00 C ATOM 316 O ASN A 425 5.583 -6.222 13.126 1.00 0.00 O ATOM 317 CB ASN A 425 7.775 -7.670 12.412 1.00 0.00 C ATOM 318 CG ASN A 425 8.473 -6.343 12.194 1.00 0.00 C ATOM 319 OD1 ASN A 425 9.700 -6.260 12.231 1.00 0.00 O ATOM 320 ND2 ASN A 425 7.691 -5.299 11.953 1.00 0.00 N ATOM 0 H ASN A 425 5.872 -9.403 14.000 1.00 0.00 H new ATOM 0 HA ASN A 425 7.991 -7.500 14.530 1.00 0.00 H new ATOM 0 HB2 ASN A 425 8.475 -8.480 12.209 1.00 0.00 H new ATOM 0 HB3 ASN A 425 6.959 -7.767 11.696 1.00 0.00 H new ATOM 0 HD21 ASN A 425 8.103 -4.380 11.789 1.00 0.00 H new ATOM 0 HD22 ASN A 425 6.678 -5.415 11.932 1.00 0.00 H new ATOM 327 N PRO A 426 5.286 -7.148 15.178 1.00 0.00 N ATOM 328 CA PRO A 426 4.046 -6.456 15.532 1.00 0.00 C ATOM 329 C PRO A 426 3.875 -5.096 14.873 1.00 0.00 C ATOM 330 O PRO A 426 3.971 -4.062 15.532 1.00 0.00 O ATOM 331 CB PRO A 426 4.206 -6.303 17.036 1.00 0.00 C ATOM 332 CG PRO A 426 4.913 -7.548 17.469 1.00 0.00 C ATOM 333 CD PRO A 426 5.683 -8.059 16.268 1.00 0.00 C ATOM 0 HA PRO A 426 3.164 -7.004 15.202 1.00 0.00 H new ATOM 0 HB2 PRO A 426 4.783 -5.412 17.285 1.00 0.00 H new ATOM 0 HB3 PRO A 426 3.239 -6.204 17.529 1.00 0.00 H new ATOM 0 HG2 PRO A 426 5.587 -7.340 18.300 1.00 0.00 H new ATOM 0 HG3 PRO A 426 4.200 -8.296 17.817 1.00 0.00 H new ATOM 0 HD2 PRO A 426 6.759 -8.030 16.441 1.00 0.00 H new ATOM 0 HD3 PRO A 426 5.425 -9.093 16.038 1.00 0.00 H new ATOM 341 N TYR A 427 3.619 -5.102 13.573 1.00 0.00 N ATOM 342 CA TYR A 427 3.446 -3.845 12.850 1.00 0.00 C ATOM 343 C TYR A 427 2.551 -3.997 11.622 1.00 0.00 C ATOM 344 O TYR A 427 2.535 -5.046 10.977 1.00 0.00 O ATOM 345 CB TYR A 427 4.809 -3.284 12.436 1.00 0.00 C ATOM 346 CG TYR A 427 5.588 -2.662 13.580 1.00 0.00 C ATOM 347 CD1 TYR A 427 6.261 -3.452 14.504 1.00 0.00 C ATOM 348 CD2 TYR A 427 5.652 -1.281 13.730 1.00 0.00 C ATOM 349 CE1 TYR A 427 6.971 -2.885 15.546 1.00 0.00 C ATOM 350 CE2 TYR A 427 6.363 -0.708 14.767 1.00 0.00 C ATOM 351 CZ TYR A 427 7.020 -1.513 15.671 1.00 0.00 C ATOM 352 OH TYR A 427 7.729 -0.946 16.705 1.00 0.00 O ATOM 0 H TYR A 427 3.527 -5.944 13.004 1.00 0.00 H new ATOM 0 HA TYR A 427 2.951 -3.150 13.528 1.00 0.00 H new ATOM 0 HB2 TYR A 427 5.403 -4.086 11.997 1.00 0.00 H new ATOM 0 HB3 TYR A 427 4.662 -2.534 11.659 1.00 0.00 H new ATOM 0 HD1 TYR A 427 6.229 -4.527 14.407 1.00 0.00 H new ATOM 0 HD2 TYR A 427 5.137 -0.646 13.024 1.00 0.00 H new ATOM 0 HE1 TYR A 427 7.485 -3.514 16.258 1.00 0.00 H new ATOM 0 HE2 TYR A 427 6.403 0.366 14.868 1.00 0.00 H new ATOM 0 HH TYR A 427 8.478 -1.530 16.947 1.00 0.00 H new ATOM 362 N PRO A 428 1.797 -2.934 11.283 1.00 0.00 N ATOM 363 CA PRO A 428 0.897 -2.931 10.131 1.00 0.00 C ATOM 364 C PRO A 428 1.636 -2.656 8.825 1.00 0.00 C ATOM 365 O PRO A 428 2.393 -1.692 8.719 1.00 0.00 O ATOM 366 CB PRO A 428 -0.060 -1.788 10.451 1.00 0.00 C ATOM 367 CG PRO A 428 0.764 -0.821 11.229 1.00 0.00 C ATOM 368 CD PRO A 428 1.765 -1.643 12.002 1.00 0.00 C ATOM 0 HA PRO A 428 0.407 -3.893 9.984 1.00 0.00 H new ATOM 0 HB2 PRO A 428 -0.454 -1.333 9.542 1.00 0.00 H new ATOM 0 HB3 PRO A 428 -0.916 -2.136 11.029 1.00 0.00 H new ATOM 0 HG2 PRO A 428 1.268 -0.118 10.566 1.00 0.00 H new ATOM 0 HG3 PRO A 428 0.141 -0.233 11.903 1.00 0.00 H new ATOM 0 HD2 PRO A 428 2.746 -1.169 12.015 1.00 0.00 H new ATOM 0 HD3 PRO A 428 1.459 -1.772 13.040 1.00 0.00 H new ATOM 376 N ARG A 429 1.413 -3.512 7.836 1.00 0.00 N ATOM 377 CA ARG A 429 2.060 -3.364 6.539 1.00 0.00 C ATOM 378 C ARG A 429 1.243 -2.455 5.627 1.00 0.00 C ATOM 379 O ARG A 429 0.036 -2.299 5.807 1.00 0.00 O ATOM 380 CB ARG A 429 2.245 -4.728 5.869 1.00 0.00 C ATOM 381 CG ARG A 429 2.625 -5.842 6.834 1.00 0.00 C ATOM 382 CD ARG A 429 2.396 -7.211 6.215 1.00 0.00 C ATOM 383 NE ARG A 429 3.554 -7.665 5.449 1.00 0.00 N ATOM 384 CZ ARG A 429 3.599 -8.819 4.788 1.00 0.00 C ATOM 385 NH1 ARG A 429 2.552 -9.635 4.793 1.00 0.00 N ATOM 386 NH2 ARG A 429 4.692 -9.158 4.120 1.00 0.00 N ATOM 0 H ARG A 429 0.789 -4.316 7.907 1.00 0.00 H new ATOM 0 HA ARG A 429 3.038 -2.913 6.705 1.00 0.00 H new ATOM 0 HB2 ARG A 429 1.320 -5.001 5.361 1.00 0.00 H new ATOM 0 HB3 ARG A 429 3.017 -4.644 5.104 1.00 0.00 H new ATOM 0 HG2 ARG A 429 3.673 -5.739 7.117 1.00 0.00 H new ATOM 0 HG3 ARG A 429 2.038 -5.751 7.748 1.00 0.00 H new ATOM 0 HD2 ARG A 429 2.176 -7.933 7.002 1.00 0.00 H new ATOM 0 HD3 ARG A 429 1.523 -7.173 5.564 1.00 0.00 H new ATOM 0 HE ARG A 429 4.376 -7.062 5.419 1.00 0.00 H new ATOM 0 HH11 ARG A 429 1.708 -9.379 5.305 1.00 0.00 H new ATOM 0 HH12 ARG A 429 2.592 -10.518 4.285 1.00 0.00 H new ATOM 0 HH21 ARG A 429 5.499 -8.534 4.112 1.00 0.00 H new ATOM 0 HH22 ARG A 429 4.726 -10.043 3.613 1.00 0.00 H new ATOM 400 N SER A 430 1.911 -1.862 4.646 1.00 0.00 N ATOM 401 CA SER A 430 1.253 -0.974 3.697 1.00 0.00 C ATOM 402 C SER A 430 1.553 -1.407 2.268 1.00 0.00 C ATOM 403 O SER A 430 2.682 -1.779 1.947 1.00 0.00 O ATOM 404 CB SER A 430 1.707 0.473 3.916 1.00 0.00 C ATOM 405 OG SER A 430 2.447 0.602 5.119 1.00 0.00 O ATOM 0 H SER A 430 2.911 -1.981 4.487 1.00 0.00 H new ATOM 0 HA SER A 430 0.177 -1.031 3.861 1.00 0.00 H new ATOM 0 HB2 SER A 430 2.318 0.797 3.074 1.00 0.00 H new ATOM 0 HB3 SER A 430 0.837 1.129 3.949 1.00 0.00 H new ATOM 0 HG SER A 430 1.996 1.236 5.714 1.00 0.00 H new ATOM 411 N TYR A 431 0.541 -1.355 1.408 1.00 0.00 N ATOM 412 CA TYR A 431 0.709 -1.742 0.015 1.00 0.00 C ATOM 413 C TYR A 431 0.486 -0.544 -0.903 1.00 0.00 C ATOM 414 O TYR A 431 -0.633 -0.052 -1.030 1.00 0.00 O ATOM 415 CB TYR A 431 -0.263 -2.872 -0.343 1.00 0.00 C ATOM 416 CG TYR A 431 -0.419 -3.922 0.742 1.00 0.00 C ATOM 417 CD1 TYR A 431 -1.069 -3.630 1.938 1.00 0.00 C ATOM 418 CD2 TYR A 431 0.082 -5.206 0.568 1.00 0.00 C ATOM 419 CE1 TYR A 431 -1.212 -4.589 2.928 1.00 0.00 C ATOM 420 CE2 TYR A 431 -0.059 -6.167 1.553 1.00 0.00 C ATOM 421 CZ TYR A 431 -0.705 -5.854 2.727 1.00 0.00 C ATOM 422 OH TYR A 431 -0.844 -6.808 3.707 1.00 0.00 O ATOM 0 H TYR A 431 -0.401 -1.049 1.652 1.00 0.00 H new ATOM 0 HA TYR A 431 1.729 -2.100 -0.124 1.00 0.00 H new ATOM 0 HB2 TYR A 431 -1.240 -2.441 -0.560 1.00 0.00 H new ATOM 0 HB3 TYR A 431 0.081 -3.357 -1.256 1.00 0.00 H new ATOM 0 HD1 TYR A 431 -1.469 -2.639 2.097 1.00 0.00 H new ATOM 0 HD2 TYR A 431 0.590 -5.458 -0.351 1.00 0.00 H new ATOM 0 HE1 TYR A 431 -1.718 -4.346 3.851 1.00 0.00 H new ATOM 0 HE2 TYR A 431 0.337 -7.160 1.401 1.00 0.00 H new ATOM 0 HH TYR A 431 -0.250 -7.564 3.515 1.00 0.00 H new ATOM 432 N TYR A 432 1.561 -0.058 -1.522 1.00 0.00 N ATOM 433 CA TYR A 432 1.472 1.099 -2.410 1.00 0.00 C ATOM 434 C TYR A 432 1.428 0.680 -3.875 1.00 0.00 C ATOM 435 O TYR A 432 2.171 -0.202 -4.305 1.00 0.00 O ATOM 436 CB TYR A 432 2.664 2.033 -2.182 1.00 0.00 C ATOM 437 CG TYR A 432 2.488 2.982 -1.018 1.00 0.00 C ATOM 438 CD1 TYR A 432 2.773 2.578 0.281 1.00 0.00 C ATOM 439 CD2 TYR A 432 2.042 4.282 -1.217 1.00 0.00 C ATOM 440 CE1 TYR A 432 2.618 3.444 1.347 1.00 0.00 C ATOM 441 CE2 TYR A 432 1.886 5.154 -0.156 1.00 0.00 C ATOM 442 CZ TYR A 432 2.175 4.729 1.123 1.00 0.00 C ATOM 443 OH TYR A 432 2.020 5.593 2.183 1.00 0.00 O ATOM 0 H TYR A 432 2.499 -0.446 -1.425 1.00 0.00 H new ATOM 0 HA TYR A 432 0.545 1.622 -2.176 1.00 0.00 H new ATOM 0 HB2 TYR A 432 3.557 1.431 -2.015 1.00 0.00 H new ATOM 0 HB3 TYR A 432 2.836 2.614 -3.088 1.00 0.00 H new ATOM 0 HD1 TYR A 432 3.121 1.571 0.460 1.00 0.00 H new ATOM 0 HD2 TYR A 432 1.813 4.617 -2.218 1.00 0.00 H new ATOM 0 HE1 TYR A 432 2.843 3.115 2.351 1.00 0.00 H new ATOM 0 HE2 TYR A 432 1.540 6.162 -0.328 1.00 0.00 H new ATOM 0 HH TYR A 432 1.937 6.510 1.848 1.00 0.00 H new ATOM 453 N LYS A 433 0.547 1.326 -4.635 1.00 0.00 N ATOM 454 CA LYS A 433 0.397 1.030 -6.055 1.00 0.00 C ATOM 455 C LYS A 433 0.626 2.276 -6.905 1.00 0.00 C ATOM 456 O LYS A 433 -0.131 3.243 -6.818 1.00 0.00 O ATOM 457 CB LYS A 433 -0.998 0.467 -6.334 1.00 0.00 C ATOM 458 CG LYS A 433 -1.035 -1.046 -6.416 1.00 0.00 C ATOM 459 CD LYS A 433 -2.143 -1.531 -7.340 1.00 0.00 C ATOM 460 CE LYS A 433 -1.960 -1.016 -8.758 1.00 0.00 C ATOM 461 NZ LYS A 433 -0.537 -1.082 -9.197 1.00 0.00 N ATOM 0 H LYS A 433 -0.074 2.058 -4.290 1.00 0.00 H new ATOM 0 HA LYS A 433 1.148 0.287 -6.322 1.00 0.00 H new ATOM 0 HB2 LYS A 433 -1.678 0.797 -5.549 1.00 0.00 H new ATOM 0 HB3 LYS A 433 -1.368 0.883 -7.271 1.00 0.00 H new ATOM 0 HG2 LYS A 433 -0.074 -1.415 -6.775 1.00 0.00 H new ATOM 0 HG3 LYS A 433 -1.184 -1.461 -5.419 1.00 0.00 H new ATOM 0 HD2 LYS A 433 -2.159 -2.621 -7.348 1.00 0.00 H new ATOM 0 HD3 LYS A 433 -3.108 -1.201 -6.955 1.00 0.00 H new ATOM 0 HE2 LYS A 433 -2.577 -1.602 -9.439 1.00 0.00 H new ATOM 0 HE3 LYS A 433 -2.310 0.014 -8.817 1.00 0.00 H new ATOM 0 HZ1 LYS A 433 -0.475 -0.851 -10.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 433 0.027 -0.400 -8.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 433 -0.169 -2.041 -9.038 1.00 0.00 H new ATOM 475 N CYS A 434 1.660 2.242 -7.740 1.00 0.00 N ATOM 476 CA CYS A 434 1.968 3.363 -8.615 1.00 0.00 C ATOM 477 C CYS A 434 1.120 3.293 -9.879 1.00 0.00 C ATOM 478 O CYS A 434 1.014 2.241 -10.510 1.00 0.00 O ATOM 479 CB CYS A 434 3.462 3.363 -8.979 1.00 0.00 C ATOM 480 SG CYS A 434 3.888 4.313 -10.462 1.00 0.00 S ATOM 0 H CYS A 434 2.297 1.450 -7.828 1.00 0.00 H new ATOM 0 HA CYS A 434 1.737 4.289 -8.088 1.00 0.00 H new ATOM 0 HB2 CYS A 434 4.026 3.762 -8.136 1.00 0.00 H new ATOM 0 HB3 CYS A 434 3.786 2.332 -9.121 1.00 0.00 H new ATOM 485 N THR A 435 0.533 4.421 -10.251 1.00 0.00 N ATOM 486 CA THR A 435 -0.289 4.495 -11.447 1.00 0.00 C ATOM 487 C THR A 435 0.386 5.390 -12.474 1.00 0.00 C ATOM 488 O THR A 435 1.094 6.329 -12.110 1.00 0.00 O ATOM 489 CB THR A 435 -1.693 5.045 -11.136 1.00 0.00 C ATOM 490 OG1 THR A 435 -1.594 6.388 -10.647 1.00 0.00 O ATOM 491 CG2 THR A 435 -2.400 4.177 -10.104 1.00 0.00 C ATOM 0 H THR A 435 0.612 5.300 -9.739 1.00 0.00 H new ATOM 0 HA THR A 435 -0.399 3.485 -11.841 1.00 0.00 H new ATOM 0 HB THR A 435 -2.276 5.034 -12.057 1.00 0.00 H new ATOM 0 HG1 THR A 435 -2.491 6.732 -10.453 1.00 0.00 H new ATOM 0 HG21 THR A 435 -3.390 4.586 -9.901 1.00 0.00 H new ATOM 0 HG22 THR A 435 -2.499 3.162 -10.489 1.00 0.00 H new ATOM 0 HG23 THR A 435 -1.818 4.161 -9.182 1.00 0.00 H new ATOM 499 N THR A 436 0.165 5.113 -13.753 1.00 0.00 N ATOM 500 CA THR A 436 0.757 5.911 -14.816 1.00 0.00 C ATOM 501 C THR A 436 0.155 5.516 -16.159 1.00 0.00 C ATOM 502 O THR A 436 -0.069 4.334 -16.412 1.00 0.00 O ATOM 503 CB THR A 436 2.288 5.728 -14.880 1.00 0.00 C ATOM 504 OG1 THR A 436 2.802 5.368 -13.592 1.00 0.00 O ATOM 505 CG2 THR A 436 2.969 6.996 -15.362 1.00 0.00 C ATOM 0 H THR A 436 -0.419 4.343 -14.078 1.00 0.00 H new ATOM 0 HA THR A 436 0.542 6.957 -14.599 1.00 0.00 H new ATOM 0 HB THR A 436 2.498 4.928 -15.589 1.00 0.00 H new ATOM 0 HG1 THR A 436 3.530 4.721 -13.700 1.00 0.00 H new ATOM 0 HG21 THR A 436 4.047 6.839 -15.398 1.00 0.00 H new ATOM 0 HG22 THR A 436 2.606 7.248 -16.358 1.00 0.00 H new ATOM 0 HG23 THR A 436 2.744 7.813 -14.677 1.00 0.00 H new ATOM 513 N PRO A 437 -0.123 6.493 -17.042 1.00 0.00 N ATOM 514 CA PRO A 437 -0.705 6.220 -18.361 1.00 0.00 C ATOM 515 C PRO A 437 0.082 5.164 -19.132 1.00 0.00 C ATOM 516 O PRO A 437 0.893 5.488 -19.998 1.00 0.00 O ATOM 517 CB PRO A 437 -0.639 7.576 -19.084 1.00 0.00 C ATOM 518 CG PRO A 437 0.241 8.440 -18.240 1.00 0.00 C ATOM 519 CD PRO A 437 0.099 7.929 -16.837 1.00 0.00 C ATOM 0 HA PRO A 437 -1.717 5.822 -18.280 1.00 0.00 H new ATOM 0 HB2 PRO A 437 -0.231 7.465 -20.089 1.00 0.00 H new ATOM 0 HB3 PRO A 437 -1.632 8.013 -19.189 1.00 0.00 H new ATOM 0 HG2 PRO A 437 1.278 8.384 -18.573 1.00 0.00 H new ATOM 0 HG3 PRO A 437 -0.059 9.486 -18.307 1.00 0.00 H new ATOM 0 HD2 PRO A 437 0.993 8.121 -16.243 1.00 0.00 H new ATOM 0 HD3 PRO A 437 -0.736 8.398 -16.317 1.00 0.00 H new ATOM 527 N GLY A 438 -0.164 3.897 -18.808 1.00 0.00 N ATOM 528 CA GLY A 438 0.528 2.811 -19.476 1.00 0.00 C ATOM 529 C GLY A 438 1.454 2.037 -18.553 1.00 0.00 C ATOM 530 O GLY A 438 2.151 1.126 -18.998 1.00 0.00 O ATOM 0 H GLY A 438 -0.831 3.604 -18.094 1.00 0.00 H new ATOM 0 HA2 GLY A 438 -0.207 2.127 -19.901 1.00 0.00 H new ATOM 0 HA3 GLY A 438 1.107 3.214 -20.307 1.00 0.00 H new ATOM 534 N CYS A 439 1.474 2.397 -17.270 1.00 0.00 N ATOM 535 CA CYS A 439 2.337 1.715 -16.309 1.00 0.00 C ATOM 536 C CYS A 439 1.605 1.418 -14.999 1.00 0.00 C ATOM 537 O CYS A 439 0.672 2.128 -14.609 1.00 0.00 O ATOM 538 CB CYS A 439 3.606 2.545 -16.050 1.00 0.00 C ATOM 539 SG CYS A 439 4.015 2.817 -14.302 1.00 0.00 S ATOM 0 H CYS A 439 0.909 3.149 -16.876 1.00 0.00 H new ATOM 0 HA CYS A 439 2.625 0.757 -16.742 1.00 0.00 H new ATOM 0 HB2 CYS A 439 4.449 2.048 -16.530 1.00 0.00 H new ATOM 0 HB3 CYS A 439 3.490 3.515 -16.534 1.00 0.00 H new ATOM 544 N GLY A 440 2.060 0.362 -14.328 1.00 0.00 N ATOM 545 CA GLY A 440 1.482 -0.045 -13.061 1.00 0.00 C ATOM 546 C GLY A 440 2.464 -0.838 -12.217 1.00 0.00 C ATOM 547 O GLY A 440 2.755 -1.996 -12.519 1.00 0.00 O ATOM 0 H GLY A 440 2.830 -0.226 -14.647 1.00 0.00 H new ATOM 0 HA2 GLY A 440 1.160 0.838 -12.509 1.00 0.00 H new ATOM 0 HA3 GLY A 440 0.593 -0.648 -13.245 1.00 0.00 H new ATOM 551 N VAL A 441 2.975 -0.214 -11.160 1.00 0.00 N ATOM 552 CA VAL A 441 3.935 -0.862 -10.269 1.00 0.00 C ATOM 553 C VAL A 441 3.423 -0.859 -8.832 1.00 0.00 C ATOM 554 O VAL A 441 2.694 0.045 -8.432 1.00 0.00 O ATOM 555 CB VAL A 441 5.305 -0.149 -10.324 1.00 0.00 C ATOM 556 CG1 VAL A 441 6.128 -0.408 -9.066 1.00 0.00 C ATOM 557 CG2 VAL A 441 6.079 -0.576 -11.559 1.00 0.00 C ATOM 0 H VAL A 441 2.740 0.743 -10.898 1.00 0.00 H new ATOM 0 HA VAL A 441 4.055 -1.892 -10.606 1.00 0.00 H new ATOM 0 HB VAL A 441 5.114 0.923 -10.379 1.00 0.00 H new ATOM 0 HG11 VAL A 441 7.084 0.110 -9.143 1.00 0.00 H new ATOM 0 HG12 VAL A 441 5.586 -0.041 -8.195 1.00 0.00 H new ATOM 0 HG13 VAL A 441 6.303 -1.479 -8.960 1.00 0.00 H new ATOM 0 HG21 VAL A 441 7.041 -0.064 -11.581 1.00 0.00 H new ATOM 0 HG22 VAL A 441 6.242 -1.653 -11.532 1.00 0.00 H new ATOM 0 HG23 VAL A 441 5.510 -0.318 -12.452 1.00 0.00 H new ATOM 567 N ARG A 442 3.809 -1.866 -8.056 1.00 0.00 N ATOM 568 CA ARG A 442 3.390 -1.962 -6.664 1.00 0.00 C ATOM 569 C ARG A 442 4.566 -1.669 -5.734 1.00 0.00 C ATOM 570 O ARG A 442 5.683 -1.430 -6.191 1.00 0.00 O ATOM 571 CB ARG A 442 2.827 -3.353 -6.373 1.00 0.00 C ATOM 572 CG ARG A 442 1.427 -3.570 -6.927 1.00 0.00 C ATOM 573 CD ARG A 442 1.342 -4.844 -7.753 1.00 0.00 C ATOM 574 NE ARG A 442 1.588 -6.037 -6.946 1.00 0.00 N ATOM 575 CZ ARG A 442 0.693 -6.567 -6.114 1.00 0.00 C ATOM 576 NH1 ARG A 442 -0.505 -6.014 -5.978 1.00 0.00 N ATOM 577 NH2 ARG A 442 1.001 -7.654 -5.419 1.00 0.00 N ATOM 0 H ARG A 442 4.412 -2.627 -8.368 1.00 0.00 H new ATOM 0 HA ARG A 442 2.609 -1.223 -6.487 1.00 0.00 H new ATOM 0 HB2 ARG A 442 3.496 -4.103 -6.795 1.00 0.00 H new ATOM 0 HB3 ARG A 442 2.811 -3.511 -5.295 1.00 0.00 H new ATOM 0 HG2 ARG A 442 0.714 -3.621 -6.104 1.00 0.00 H new ATOM 0 HG3 ARG A 442 1.143 -2.717 -7.543 1.00 0.00 H new ATOM 0 HD2 ARG A 442 0.356 -4.914 -8.212 1.00 0.00 H new ATOM 0 HD3 ARG A 442 2.068 -4.799 -8.564 1.00 0.00 H new ATOM 0 HE ARG A 442 2.498 -6.490 -7.024 1.00 0.00 H new ATOM 0 HH11 ARG A 442 -0.745 -5.179 -6.512 1.00 0.00 H new ATOM 0 HH12 ARG A 442 -1.186 -6.424 -5.339 1.00 0.00 H new ATOM 0 HH21 ARG A 442 1.921 -8.082 -5.522 1.00 0.00 H new ATOM 0 HH22 ARG A 442 0.318 -8.062 -4.781 1.00 0.00 H new ATOM 591 N LYS A 443 4.311 -1.695 -4.430 1.00 0.00 N ATOM 592 CA LYS A 443 5.353 -1.437 -3.443 1.00 0.00 C ATOM 593 C LYS A 443 4.896 -1.858 -2.052 1.00 0.00 C ATOM 594 O LYS A 443 3.739 -1.658 -1.681 1.00 0.00 O ATOM 595 CB LYS A 443 5.735 0.044 -3.445 1.00 0.00 C ATOM 596 CG LYS A 443 6.769 0.413 -2.394 1.00 0.00 C ATOM 597 CD LYS A 443 7.232 1.852 -2.555 1.00 0.00 C ATOM 598 CE LYS A 443 6.287 2.822 -1.864 1.00 0.00 C ATOM 599 NZ LYS A 443 5.477 3.597 -2.843 1.00 0.00 N ATOM 0 H LYS A 443 3.393 -1.892 -4.032 1.00 0.00 H new ATOM 0 HA LYS A 443 6.229 -2.027 -3.712 1.00 0.00 H new ATOM 0 HB2 LYS A 443 6.121 0.309 -4.429 1.00 0.00 H new ATOM 0 HB3 LYS A 443 4.838 0.641 -3.284 1.00 0.00 H new ATOM 0 HG2 LYS A 443 6.345 0.274 -1.399 1.00 0.00 H new ATOM 0 HG3 LYS A 443 7.625 -0.257 -2.472 1.00 0.00 H new ATOM 0 HD2 LYS A 443 8.234 1.961 -2.141 1.00 0.00 H new ATOM 0 HD3 LYS A 443 7.297 2.098 -3.615 1.00 0.00 H new ATOM 0 HE2 LYS A 443 5.623 2.270 -1.199 1.00 0.00 H new ATOM 0 HE3 LYS A 443 6.862 3.509 -1.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 443 5.095 4.447 -2.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 443 6.077 3.878 -3.645 1.00 0.00 H new ATOM 0 HZ3 LYS A 443 4.692 3.008 -3.188 1.00 0.00 H new ATOM 613 N HIS A 444 5.810 -2.442 -1.287 1.00 0.00 N ATOM 614 CA HIS A 444 5.503 -2.893 0.065 1.00 0.00 C ATOM 615 C HIS A 444 6.248 -2.049 1.092 1.00 0.00 C ATOM 616 O HIS A 444 7.433 -1.761 0.929 1.00 0.00 O ATOM 617 CB HIS A 444 5.881 -4.366 0.227 1.00 0.00 C ATOM 618 CG HIS A 444 4.717 -5.301 0.132 1.00 0.00 C ATOM 619 ND1 HIS A 444 4.430 -6.032 -1.003 1.00 0.00 N ATOM 620 CD2 HIS A 444 3.765 -5.629 1.037 1.00 0.00 C ATOM 621 CE1 HIS A 444 3.354 -6.768 -0.790 1.00 0.00 C ATOM 622 NE2 HIS A 444 2.931 -6.543 0.441 1.00 0.00 N ATOM 0 H HIS A 444 6.772 -2.615 -1.580 1.00 0.00 H new ATOM 0 HA HIS A 444 4.432 -2.780 0.232 1.00 0.00 H new ATOM 0 HB2 HIS A 444 6.611 -4.631 -0.538 1.00 0.00 H new ATOM 0 HB3 HIS A 444 6.367 -4.503 1.193 1.00 0.00 H new ATOM 0 HD1 HIS A 444 4.965 -6.008 -1.871 1.00 0.00 H new ATOM 0 HD2 HIS A 444 3.678 -5.243 2.042 1.00 0.00 H new ATOM 0 HE1 HIS A 444 2.897 -7.440 -1.502 1.00 0.00 H new ATOM 631 N VAL A 445 5.548 -1.656 2.150 1.00 0.00 N ATOM 632 CA VAL A 445 6.149 -0.848 3.201 1.00 0.00 C ATOM 633 C VAL A 445 5.835 -1.425 4.576 1.00 0.00 C ATOM 634 O VAL A 445 4.670 -1.576 4.944 1.00 0.00 O ATOM 635 CB VAL A 445 5.656 0.610 3.137 1.00 0.00 C ATOM 636 CG1 VAL A 445 6.448 1.486 4.095 1.00 0.00 C ATOM 637 CG2 VAL A 445 5.750 1.145 1.716 1.00 0.00 C ATOM 0 H VAL A 445 4.565 -1.884 2.301 1.00 0.00 H new ATOM 0 HA VAL A 445 7.227 -0.863 3.042 1.00 0.00 H new ATOM 0 HB VAL A 445 4.610 0.632 3.441 1.00 0.00 H new ATOM 0 HG11 VAL A 445 6.085 2.512 4.035 1.00 0.00 H new ATOM 0 HG12 VAL A 445 6.324 1.116 5.113 1.00 0.00 H new ATOM 0 HG13 VAL A 445 7.504 1.459 3.825 1.00 0.00 H new ATOM 0 HG21 VAL A 445 5.397 2.176 1.691 1.00 0.00 H new ATOM 0 HG22 VAL A 445 6.787 1.108 1.381 1.00 0.00 H new ATOM 0 HG23 VAL A 445 5.134 0.535 1.056 1.00 0.00 H new ATOM 647 N GLU A 446 6.880 -1.757 5.327 1.00 0.00 N ATOM 648 CA GLU A 446 6.715 -2.330 6.657 1.00 0.00 C ATOM 649 C GLU A 446 7.665 -1.684 7.659 1.00 0.00 C ATOM 650 O GLU A 446 8.719 -1.169 7.287 1.00 0.00 O ATOM 651 CB GLU A 446 6.968 -3.838 6.616 1.00 0.00 C ATOM 652 CG GLU A 446 5.743 -4.656 6.258 1.00 0.00 C ATOM 653 CD GLU A 446 5.649 -4.948 4.772 1.00 0.00 C ATOM 654 OE1 GLU A 446 5.244 -4.042 4.014 1.00 0.00 O ATOM 655 OE2 GLU A 446 5.979 -6.081 4.367 1.00 0.00 O ATOM 0 H GLU A 446 7.851 -1.639 5.037 1.00 0.00 H new ATOM 0 HA GLU A 446 5.691 -2.138 6.977 1.00 0.00 H new ATOM 0 HB2 GLU A 446 7.756 -4.045 5.891 1.00 0.00 H new ATOM 0 HB3 GLU A 446 7.337 -4.161 7.589 1.00 0.00 H new ATOM 0 HG2 GLU A 446 5.765 -5.597 6.808 1.00 0.00 H new ATOM 0 HG3 GLU A 446 4.848 -4.121 6.577 1.00 0.00 H new ATOM 662 N ARG A 447 7.285 -1.723 8.931 1.00 0.00 N ATOM 663 CA ARG A 447 8.104 -1.150 9.991 1.00 0.00 C ATOM 664 C ARG A 447 8.962 -2.228 10.647 1.00 0.00 C ATOM 665 O ARG A 447 8.718 -3.421 10.464 1.00 0.00 O ATOM 666 CB ARG A 447 7.217 -0.474 11.037 1.00 0.00 C ATOM 667 CG ARG A 447 6.417 0.699 10.491 1.00 0.00 C ATOM 668 CD ARG A 447 5.113 0.238 9.857 1.00 0.00 C ATOM 669 NE ARG A 447 4.365 1.351 9.273 1.00 0.00 N ATOM 670 CZ ARG A 447 4.125 1.491 7.969 1.00 0.00 C ATOM 671 NH1 ARG A 447 4.582 0.601 7.095 1.00 0.00 N ATOM 672 NH2 ARG A 447 3.425 2.530 7.535 1.00 0.00 N ATOM 0 H ARG A 447 6.414 -2.146 9.253 1.00 0.00 H new ATOM 0 HA ARG A 447 8.764 -0.402 9.551 1.00 0.00 H new ATOM 0 HB2 ARG A 447 6.529 -1.212 11.449 1.00 0.00 H new ATOM 0 HB3 ARG A 447 7.841 -0.126 11.860 1.00 0.00 H new ATOM 0 HG2 ARG A 447 6.203 1.401 11.297 1.00 0.00 H new ATOM 0 HG3 ARG A 447 7.013 1.234 9.752 1.00 0.00 H new ATOM 0 HD2 ARG A 447 5.327 -0.500 9.084 1.00 0.00 H new ATOM 0 HD3 ARG A 447 4.499 -0.257 10.610 1.00 0.00 H new ATOM 0 HE ARG A 447 4.004 2.066 9.904 1.00 0.00 H new ATOM 0 HH11 ARG A 447 5.123 -0.201 7.419 1.00 0.00 H new ATOM 0 HH12 ARG A 447 4.392 0.719 6.100 1.00 0.00 H new ATOM 0 HH21 ARG A 447 3.072 3.220 8.198 1.00 0.00 H new ATOM 0 HH22 ARG A 447 3.240 2.640 6.538 1.00 0.00 H new ATOM 686 N ALA A 448 9.966 -1.806 11.407 1.00 0.00 N ATOM 687 CA ALA A 448 10.855 -2.744 12.082 1.00 0.00 C ATOM 688 C ALA A 448 10.370 -3.049 13.497 1.00 0.00 C ATOM 689 O ALA A 448 10.068 -2.141 14.273 1.00 0.00 O ATOM 690 CB ALA A 448 12.275 -2.199 12.108 1.00 0.00 C ATOM 0 H ALA A 448 10.184 -0.823 11.571 1.00 0.00 H new ATOM 0 HA ALA A 448 10.848 -3.679 11.521 1.00 0.00 H new ATOM 0 HB1 ALA A 448 12.928 -2.909 12.615 1.00 0.00 H new ATOM 0 HB2 ALA A 448 12.626 -2.048 11.087 1.00 0.00 H new ATOM 0 HB3 ALA A 448 12.290 -1.248 12.641 1.00 0.00 H new ATOM 696 N ALA A 449 10.284 -4.339 13.818 1.00 0.00 N ATOM 697 CA ALA A 449 9.822 -4.782 15.131 1.00 0.00 C ATOM 698 C ALA A 449 10.515 -4.033 16.266 1.00 0.00 C ATOM 699 O ALA A 449 9.858 -3.495 17.156 1.00 0.00 O ATOM 700 CB ALA A 449 10.037 -6.280 15.288 1.00 0.00 C ATOM 0 H ALA A 449 10.530 -5.098 13.183 1.00 0.00 H new ATOM 0 HA ALA A 449 8.757 -4.559 15.192 1.00 0.00 H new ATOM 0 HB1 ALA A 449 9.688 -6.597 16.271 1.00 0.00 H new ATOM 0 HB2 ALA A 449 9.479 -6.811 14.517 1.00 0.00 H new ATOM 0 HB3 ALA A 449 11.098 -6.508 15.189 1.00 0.00 H new ATOM 706 N THR A 450 11.845 -4.010 16.237 1.00 0.00 N ATOM 707 CA THR A 450 12.614 -3.335 17.276 1.00 0.00 C ATOM 708 C THR A 450 13.021 -1.929 16.848 1.00 0.00 C ATOM 709 O THR A 450 14.063 -1.422 17.264 1.00 0.00 O ATOM 710 CB THR A 450 13.879 -4.133 17.644 1.00 0.00 C ATOM 711 OG1 THR A 450 14.592 -3.465 18.693 1.00 0.00 O ATOM 712 CG2 THR A 450 14.788 -4.302 16.436 1.00 0.00 C ATOM 0 H THR A 450 12.409 -4.449 15.509 1.00 0.00 H new ATOM 0 HA THR A 450 11.965 -3.267 18.149 1.00 0.00 H new ATOM 0 HB THR A 450 13.569 -5.121 17.985 1.00 0.00 H new ATOM 0 HG1 THR A 450 14.794 -2.547 18.418 1.00 0.00 H new ATOM 0 HG21 THR A 450 15.674 -4.869 16.723 1.00 0.00 H new ATOM 0 HG22 THR A 450 14.254 -4.837 15.651 1.00 0.00 H new ATOM 0 HG23 THR A 450 15.089 -3.321 16.067 1.00 0.00 H new ATOM 720 N ASP A 451 12.195 -1.301 16.018 1.00 0.00 N ATOM 721 CA ASP A 451 12.475 0.046 15.542 1.00 0.00 C ATOM 722 C ASP A 451 11.295 0.604 14.750 1.00 0.00 C ATOM 723 O ASP A 451 11.221 0.438 13.533 1.00 0.00 O ATOM 724 CB ASP A 451 13.733 0.051 14.673 1.00 0.00 C ATOM 725 CG ASP A 451 14.327 1.440 14.522 1.00 0.00 C ATOM 726 OD1 ASP A 451 13.587 2.426 14.714 1.00 0.00 O ATOM 727 OD2 ASP A 451 15.533 1.538 14.211 1.00 0.00 O ATOM 0 H ASP A 451 11.328 -1.704 15.662 1.00 0.00 H new ATOM 0 HA ASP A 451 12.638 0.683 16.412 1.00 0.00 H new ATOM 0 HB2 ASP A 451 14.477 -0.614 15.112 1.00 0.00 H new ATOM 0 HB3 ASP A 451 13.492 -0.347 13.687 1.00 0.00 H new ATOM 732 N PRO A 452 10.352 1.281 15.431 1.00 0.00 N ATOM 733 CA PRO A 452 9.177 1.864 14.777 1.00 0.00 C ATOM 734 C PRO A 452 9.546 3.004 13.829 1.00 0.00 C ATOM 735 O PRO A 452 8.725 3.445 13.026 1.00 0.00 O ATOM 736 CB PRO A 452 8.337 2.392 15.946 1.00 0.00 C ATOM 737 CG PRO A 452 9.310 2.596 17.054 1.00 0.00 C ATOM 738 CD PRO A 452 10.360 1.534 16.883 1.00 0.00 C ATOM 0 HA PRO A 452 8.655 1.134 14.158 1.00 0.00 H new ATOM 0 HB2 PRO A 452 7.836 3.324 15.684 1.00 0.00 H new ATOM 0 HB3 PRO A 452 7.561 1.681 16.228 1.00 0.00 H new ATOM 0 HG2 PRO A 452 9.751 3.592 17.008 1.00 0.00 H new ATOM 0 HG3 PRO A 452 8.821 2.509 18.024 1.00 0.00 H new ATOM 0 HD2 PRO A 452 11.337 1.875 17.227 1.00 0.00 H new ATOM 0 HD3 PRO A 452 10.119 0.635 17.450 1.00 0.00 H new ATOM 746 N LYS A 453 10.787 3.474 13.928 1.00 0.00 N ATOM 747 CA LYS A 453 11.262 4.559 13.078 1.00 0.00 C ATOM 748 C LYS A 453 11.878 4.018 11.789 1.00 0.00 C ATOM 749 O LYS A 453 11.985 4.739 10.795 1.00 0.00 O ATOM 750 CB LYS A 453 12.287 5.412 13.830 1.00 0.00 C ATOM 751 CG LYS A 453 11.689 6.651 14.477 1.00 0.00 C ATOM 752 CD LYS A 453 10.960 7.518 13.461 1.00 0.00 C ATOM 753 CE LYS A 453 9.449 7.378 13.583 1.00 0.00 C ATOM 754 NZ LYS A 453 8.836 6.845 12.334 1.00 0.00 N ATOM 0 H LYS A 453 11.480 3.120 14.588 1.00 0.00 H new ATOM 0 HA LYS A 453 10.406 5.179 12.814 1.00 0.00 H new ATOM 0 HB2 LYS A 453 12.760 4.802 14.600 1.00 0.00 H new ATOM 0 HB3 LYS A 453 13.072 5.717 13.138 1.00 0.00 H new ATOM 0 HG2 LYS A 453 10.997 6.353 15.265 1.00 0.00 H new ATOM 0 HG3 LYS A 453 12.480 7.232 14.951 1.00 0.00 H new ATOM 0 HD2 LYS A 453 11.242 8.561 13.604 1.00 0.00 H new ATOM 0 HD3 LYS A 453 11.271 7.239 12.454 1.00 0.00 H new ATOM 0 HE2 LYS A 453 9.212 6.715 14.415 1.00 0.00 H new ATOM 0 HE3 LYS A 453 9.012 8.349 13.815 1.00 0.00 H new ATOM 0 HZ1 LYS A 453 8.204 7.562 11.924 1.00 0.00 H new ATOM 0 HZ2 LYS A 453 9.585 6.613 11.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 453 8.290 5.988 12.554 1.00 0.00 H new ATOM 768 N ALA A 454 12.277 2.749 11.806 1.00 0.00 N ATOM 769 CA ALA A 454 12.872 2.121 10.633 1.00 0.00 C ATOM 770 C ALA A 454 11.801 1.478 9.761 1.00 0.00 C ATOM 771 O ALA A 454 10.965 0.717 10.250 1.00 0.00 O ATOM 772 CB ALA A 454 13.906 1.087 11.055 1.00 0.00 C ATOM 0 H ALA A 454 12.199 2.137 12.618 1.00 0.00 H new ATOM 0 HA ALA A 454 13.369 2.893 10.046 1.00 0.00 H new ATOM 0 HB1 ALA A 454 14.342 0.626 10.169 1.00 0.00 H new ATOM 0 HB2 ALA A 454 14.691 1.573 11.635 1.00 0.00 H new ATOM 0 HB3 ALA A 454 13.427 0.321 11.664 1.00 0.00 H new ATOM 778 N VAL A 455 11.822 1.795 8.470 1.00 0.00 N ATOM 779 CA VAL A 455 10.841 1.251 7.539 1.00 0.00 C ATOM 780 C VAL A 455 11.511 0.483 6.404 1.00 0.00 C ATOM 781 O VAL A 455 12.618 0.818 5.978 1.00 0.00 O ATOM 782 CB VAL A 455 9.966 2.368 6.937 1.00 0.00 C ATOM 783 CG1 VAL A 455 8.815 1.774 6.140 1.00 0.00 C ATOM 784 CG2 VAL A 455 9.449 3.290 8.030 1.00 0.00 C ATOM 0 H VAL A 455 12.505 2.423 8.047 1.00 0.00 H new ATOM 0 HA VAL A 455 10.214 0.566 8.110 1.00 0.00 H new ATOM 0 HB VAL A 455 10.580 2.959 6.258 1.00 0.00 H new ATOM 0 HG11 VAL A 455 8.208 2.578 5.723 1.00 0.00 H new ATOM 0 HG12 VAL A 455 9.211 1.161 5.331 1.00 0.00 H new ATOM 0 HG13 VAL A 455 8.199 1.157 6.795 1.00 0.00 H new ATOM 0 HG21 VAL A 455 8.833 4.072 7.585 1.00 0.00 H new ATOM 0 HG22 VAL A 455 8.851 2.716 8.738 1.00 0.00 H new ATOM 0 HG23 VAL A 455 10.292 3.744 8.552 1.00 0.00 H new ATOM 794 N VAL A 456 10.822 -0.539 5.908 1.00 0.00 N ATOM 795 CA VAL A 456 11.329 -1.353 4.808 1.00 0.00 C ATOM 796 C VAL A 456 10.539 -1.052 3.535 1.00 0.00 C ATOM 797 O VAL A 456 9.334 -0.816 3.594 1.00 0.00 O ATOM 798 CB VAL A 456 11.265 -2.871 5.134 1.00 0.00 C ATOM 799 CG1 VAL A 456 11.437 -3.111 6.627 1.00 0.00 C ATOM 800 CG2 VAL A 456 9.962 -3.494 4.644 1.00 0.00 C ATOM 0 H VAL A 456 9.905 -0.825 6.252 1.00 0.00 H new ATOM 0 HA VAL A 456 12.377 -1.096 4.657 1.00 0.00 H new ATOM 0 HB VAL A 456 12.087 -3.353 4.606 1.00 0.00 H new ATOM 0 HG11 VAL A 456 11.389 -4.181 6.832 1.00 0.00 H new ATOM 0 HG12 VAL A 456 12.404 -2.723 6.949 1.00 0.00 H new ATOM 0 HG13 VAL A 456 10.642 -2.601 7.171 1.00 0.00 H new ATOM 0 HG21 VAL A 456 9.952 -4.556 4.889 1.00 0.00 H new ATOM 0 HG22 VAL A 456 9.119 -3.002 5.128 1.00 0.00 H new ATOM 0 HG23 VAL A 456 9.883 -3.370 3.564 1.00 0.00 H new ATOM 810 N THR A 457 11.214 -1.051 2.390 1.00 0.00 N ATOM 811 CA THR A 457 10.542 -0.764 1.127 1.00 0.00 C ATOM 812 C THR A 457 10.899 -1.774 0.042 1.00 0.00 C ATOM 813 O THR A 457 12.070 -1.961 -0.290 1.00 0.00 O ATOM 814 CB THR A 457 10.876 0.649 0.618 1.00 0.00 C ATOM 815 OG1 THR A 457 10.971 1.557 1.722 1.00 0.00 O ATOM 816 CG2 THR A 457 9.812 1.133 -0.355 1.00 0.00 C ATOM 0 H THR A 457 12.213 -1.243 2.310 1.00 0.00 H new ATOM 0 HA THR A 457 9.474 -0.833 1.334 1.00 0.00 H new ATOM 0 HB THR A 457 11.833 0.611 0.098 1.00 0.00 H new ATOM 0 HG1 THR A 457 11.186 2.454 1.390 1.00 0.00 H new ATOM 0 HG21 THR A 457 10.066 2.134 -0.704 1.00 0.00 H new ATOM 0 HG22 THR A 457 9.762 0.454 -1.206 1.00 0.00 H new ATOM 0 HG23 THR A 457 8.845 1.158 0.147 1.00 0.00 H new ATOM 824 N THR A 458 9.876 -2.412 -0.515 1.00 0.00 N ATOM 825 CA THR A 458 10.063 -3.393 -1.575 1.00 0.00 C ATOM 826 C THR A 458 9.345 -2.949 -2.847 1.00 0.00 C ATOM 827 O THR A 458 8.158 -2.623 -2.815 1.00 0.00 O ATOM 828 CB THR A 458 9.542 -4.781 -1.157 1.00 0.00 C ATOM 829 OG1 THR A 458 9.413 -4.847 0.269 1.00 0.00 O ATOM 830 CG2 THR A 458 10.480 -5.879 -1.636 1.00 0.00 C ATOM 0 H THR A 458 8.903 -2.265 -0.247 1.00 0.00 H new ATOM 0 HA THR A 458 11.134 -3.465 -1.765 1.00 0.00 H new ATOM 0 HB THR A 458 8.566 -4.932 -1.618 1.00 0.00 H new ATOM 0 HG1 THR A 458 9.080 -5.732 0.527 1.00 0.00 H new ATOM 0 HG21 THR A 458 10.091 -6.850 -1.329 1.00 0.00 H new ATOM 0 HG22 THR A 458 10.554 -5.845 -2.723 1.00 0.00 H new ATOM 0 HG23 THR A 458 11.468 -5.730 -1.200 1.00 0.00 H new ATOM 838 N TYR A 459 10.068 -2.933 -3.962 1.00 0.00 N ATOM 839 CA TYR A 459 9.488 -2.522 -5.237 1.00 0.00 C ATOM 840 C TYR A 459 9.155 -3.730 -6.105 1.00 0.00 C ATOM 841 O TYR A 459 10.026 -4.546 -6.412 1.00 0.00 O ATOM 842 CB TYR A 459 10.450 -1.593 -5.982 1.00 0.00 C ATOM 843 CG TYR A 459 10.475 -0.182 -5.440 1.00 0.00 C ATOM 844 CD1 TYR A 459 9.356 0.639 -5.527 1.00 0.00 C ATOM 845 CD2 TYR A 459 11.619 0.332 -4.843 1.00 0.00 C ATOM 846 CE1 TYR A 459 9.377 1.930 -5.036 1.00 0.00 C ATOM 847 CE2 TYR A 459 11.648 1.623 -4.347 1.00 0.00 C ATOM 848 CZ TYR A 459 10.525 2.417 -4.446 1.00 0.00 C ATOM 849 OH TYR A 459 10.551 3.701 -3.955 1.00 0.00 O ATOM 0 H TYR A 459 11.052 -3.198 -4.010 1.00 0.00 H new ATOM 0 HA TYR A 459 8.562 -1.986 -5.028 1.00 0.00 H new ATOM 0 HB2 TYR A 459 11.456 -2.010 -5.931 1.00 0.00 H new ATOM 0 HB3 TYR A 459 10.170 -1.563 -7.035 1.00 0.00 H new ATOM 0 HD1 TYR A 459 8.455 0.261 -5.986 1.00 0.00 H new ATOM 0 HD2 TYR A 459 12.501 -0.287 -4.765 1.00 0.00 H new ATOM 0 HE1 TYR A 459 8.499 2.555 -5.114 1.00 0.00 H new ATOM 0 HE2 TYR A 459 12.545 2.007 -3.885 1.00 0.00 H new ATOM 0 HH TYR A 459 11.433 3.887 -3.571 1.00 0.00 H new ATOM 859 N GLU A 460 7.890 -3.838 -6.497 1.00 0.00 N ATOM 860 CA GLU A 460 7.438 -4.947 -7.330 1.00 0.00 C ATOM 861 C GLU A 460 7.184 -4.485 -8.762 1.00 0.00 C ATOM 862 O GLU A 460 6.121 -3.946 -9.070 1.00 0.00 O ATOM 863 CB GLU A 460 6.167 -5.563 -6.747 1.00 0.00 C ATOM 864 CG GLU A 460 6.414 -6.420 -5.515 1.00 0.00 C ATOM 865 CD GLU A 460 5.159 -6.625 -4.687 1.00 0.00 C ATOM 866 OE1 GLU A 460 4.126 -7.023 -5.264 1.00 0.00 O ATOM 867 OE2 GLU A 460 5.212 -6.388 -3.463 1.00 0.00 O ATOM 0 H GLU A 460 7.159 -3.171 -6.251 1.00 0.00 H new ATOM 0 HA GLU A 460 8.225 -5.701 -7.346 1.00 0.00 H new ATOM 0 HB2 GLU A 460 5.471 -4.764 -6.490 1.00 0.00 H new ATOM 0 HB3 GLU A 460 5.685 -6.172 -7.512 1.00 0.00 H new ATOM 0 HG2 GLU A 460 6.804 -7.390 -5.824 1.00 0.00 H new ATOM 0 HG3 GLU A 460 7.180 -5.950 -4.898 1.00 0.00 H new ATOM 874 N GLY A 461 8.165 -4.701 -9.634 1.00 0.00 N ATOM 875 CA GLY A 461 8.024 -4.302 -11.023 1.00 0.00 C ATOM 876 C GLY A 461 8.557 -2.906 -11.285 1.00 0.00 C ATOM 877 O GLY A 461 8.445 -2.022 -10.435 1.00 0.00 O ATOM 0 H GLY A 461 9.054 -5.145 -9.404 1.00 0.00 H new ATOM 0 HA2 GLY A 461 8.552 -5.014 -11.657 1.00 0.00 H new ATOM 0 HA3 GLY A 461 6.972 -4.344 -11.304 1.00 0.00 H new ATOM 881 N LYS A 462 9.135 -2.708 -12.466 1.00 0.00 N ATOM 882 CA LYS A 462 9.685 -1.409 -12.841 1.00 0.00 C ATOM 883 C LYS A 462 8.643 -0.567 -13.570 1.00 0.00 C ATOM 884 O LYS A 462 7.520 -1.013 -13.801 1.00 0.00 O ATOM 885 CB LYS A 462 10.922 -1.589 -13.721 1.00 0.00 C ATOM 886 CG LYS A 462 10.621 -2.217 -15.073 1.00 0.00 C ATOM 887 CD LYS A 462 11.409 -1.550 -16.188 1.00 0.00 C ATOM 888 CE LYS A 462 11.374 -2.374 -17.464 1.00 0.00 C ATOM 889 NZ LYS A 462 11.600 -1.537 -18.673 1.00 0.00 N ATOM 0 H LYS A 462 9.235 -3.430 -13.180 1.00 0.00 H new ATOM 0 HA LYS A 462 9.972 -0.887 -11.928 1.00 0.00 H new ATOM 0 HB2 LYS A 462 11.391 -0.618 -13.877 1.00 0.00 H new ATOM 0 HB3 LYS A 462 11.645 -2.211 -13.194 1.00 0.00 H new ATOM 0 HG2 LYS A 462 10.861 -3.280 -15.043 1.00 0.00 H new ATOM 0 HG3 LYS A 462 9.554 -2.137 -15.282 1.00 0.00 H new ATOM 0 HD2 LYS A 462 10.999 -0.559 -16.382 1.00 0.00 H new ATOM 0 HD3 LYS A 462 12.443 -1.411 -15.872 1.00 0.00 H new ATOM 0 HE2 LYS A 462 12.135 -3.152 -17.414 1.00 0.00 H new ATOM 0 HE3 LYS A 462 10.410 -2.876 -17.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 462 11.804 -2.151 -19.487 1.00 0.00 H new ATOM 0 HZ2 LYS A 462 10.748 -0.974 -18.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 462 12.406 -0.900 -18.509 1.00 0.00 H new ATOM 903 N HIS A 463 9.026 0.653 -13.934 1.00 0.00 N ATOM 904 CA HIS A 463 8.124 1.559 -14.639 1.00 0.00 C ATOM 905 C HIS A 463 8.669 1.909 -16.017 1.00 0.00 C ATOM 906 O HIS A 463 9.868 2.128 -16.185 1.00 0.00 O ATOM 907 CB HIS A 463 7.908 2.841 -13.831 1.00 0.00 C ATOM 908 CG HIS A 463 7.749 2.601 -12.364 1.00 0.00 C ATOM 909 ND1 HIS A 463 6.667 3.051 -11.639 1.00 0.00 N ATOM 910 CD2 HIS A 463 8.545 1.952 -11.483 1.00 0.00 C ATOM 911 CE1 HIS A 463 6.803 2.689 -10.375 1.00 0.00 C ATOM 912 NE2 HIS A 463 7.936 2.018 -10.255 1.00 0.00 N ATOM 0 H HIS A 463 9.953 1.037 -13.753 1.00 0.00 H new ATOM 0 HA HIS A 463 7.169 1.048 -14.760 1.00 0.00 H new ATOM 0 HB2 HIS A 463 8.754 3.510 -13.992 1.00 0.00 H new ATOM 0 HB3 HIS A 463 7.021 3.352 -14.206 1.00 0.00 H new ATOM 0 HD2 HIS A 463 9.486 1.471 -11.705 1.00 0.00 H new ATOM 0 HE1 HIS A 463 6.108 2.904 -9.577 1.00 0.00 H new ATOM 0 HE2 HIS A 463 8.298 1.615 -9.391 1.00 0.00 H new ATOM 920 N ASN A 464 7.779 1.962 -16.998 1.00 0.00 N ATOM 921 CA ASN A 464 8.168 2.290 -18.361 1.00 0.00 C ATOM 922 C ASN A 464 7.795 3.730 -18.704 1.00 0.00 C ATOM 923 O ASN A 464 7.113 3.986 -19.697 1.00 0.00 O ATOM 924 CB ASN A 464 7.505 1.325 -19.348 1.00 0.00 C ATOM 925 CG ASN A 464 7.952 -0.109 -19.143 1.00 0.00 C ATOM 926 OD1 ASN A 464 9.142 -0.385 -18.993 1.00 0.00 O ATOM 927 ND2 ASN A 464 6.996 -1.032 -19.137 1.00 0.00 N ATOM 0 H ASN A 464 6.783 1.782 -16.875 1.00 0.00 H new ATOM 0 HA ASN A 464 9.251 2.190 -18.438 1.00 0.00 H new ATOM 0 HB2 ASN A 464 6.422 1.384 -19.238 1.00 0.00 H new ATOM 0 HB3 ASN A 464 7.739 1.634 -20.367 1.00 0.00 H new ATOM 0 HD21 ASN A 464 7.236 -2.014 -19.004 1.00 0.00 H new ATOM 0 HD22 ASN A 464 6.022 -0.758 -19.265 1.00 0.00 H new ATOM 934 N HIS A 465 8.249 4.672 -17.878 1.00 0.00 N ATOM 935 CA HIS A 465 7.967 6.085 -18.098 1.00 0.00 C ATOM 936 C HIS A 465 8.949 6.956 -17.322 1.00 0.00 C ATOM 937 O HIS A 465 9.350 6.613 -16.209 1.00 0.00 O ATOM 938 CB HIS A 465 6.532 6.421 -17.677 1.00 0.00 C ATOM 939 CG HIS A 465 6.274 6.245 -16.211 1.00 0.00 C ATOM 940 ND1 HIS A 465 6.625 7.185 -15.261 1.00 0.00 N ATOM 941 CD2 HIS A 465 5.685 5.232 -15.533 1.00 0.00 C ATOM 942 CE1 HIS A 465 6.263 6.755 -14.063 1.00 0.00 C ATOM 943 NE2 HIS A 465 5.690 5.572 -14.202 1.00 0.00 N ATOM 0 H HIS A 465 8.814 4.479 -17.051 1.00 0.00 H new ATOM 0 HA HIS A 465 8.080 6.289 -19.163 1.00 0.00 H new ATOM 0 HB2 HIS A 465 6.315 7.453 -17.953 1.00 0.00 H new ATOM 0 HB3 HIS A 465 5.842 5.789 -18.236 1.00 0.00 H new ATOM 0 HD1 HIS A 465 7.091 8.072 -15.453 1.00 0.00 H new ATOM 0 HD2 HIS A 465 5.285 4.324 -15.960 1.00 0.00 H new ATOM 0 HE1 HIS A 465 6.410 7.281 -13.131 1.00 0.00 H new ATOM 951 N ASP A 466 9.333 8.083 -17.910 1.00 0.00 N ATOM 952 CA ASP A 466 10.265 8.998 -17.266 1.00 0.00 C ATOM 953 C ASP A 466 9.587 9.732 -16.113 1.00 0.00 C ATOM 954 O ASP A 466 8.410 9.510 -15.831 1.00 0.00 O ATOM 955 CB ASP A 466 10.805 10.006 -18.283 1.00 0.00 C ATOM 956 CG ASP A 466 12.271 10.323 -18.062 1.00 0.00 C ATOM 957 OD1 ASP A 466 12.605 10.875 -16.990 1.00 0.00 O ATOM 958 OD2 ASP A 466 13.086 10.020 -18.958 1.00 0.00 O ATOM 0 H ASP A 466 9.013 8.384 -18.831 1.00 0.00 H new ATOM 0 HA ASP A 466 11.096 8.417 -16.867 1.00 0.00 H new ATOM 0 HB2 ASP A 466 10.670 9.610 -19.290 1.00 0.00 H new ATOM 0 HB3 ASP A 466 10.224 10.926 -18.222 1.00 0.00 H new ATOM 963 N LEU A 467 10.335 10.609 -15.453 1.00 0.00 N ATOM 964 CA LEU A 467 9.800 11.373 -14.334 1.00 0.00 C ATOM 965 C LEU A 467 8.760 12.384 -14.819 1.00 0.00 C ATOM 966 O LEU A 467 9.052 13.222 -15.671 1.00 0.00 O ATOM 967 CB LEU A 467 10.928 12.094 -13.595 1.00 0.00 C ATOM 968 CG LEU A 467 11.318 11.474 -12.253 1.00 0.00 C ATOM 969 CD1 LEU A 467 10.188 11.629 -11.248 1.00 0.00 C ATOM 970 CD2 LEU A 467 11.684 10.007 -12.429 1.00 0.00 C ATOM 0 H LEU A 467 11.311 10.808 -15.673 1.00 0.00 H new ATOM 0 HA LEU A 467 9.315 10.679 -13.647 1.00 0.00 H new ATOM 0 HB2 LEU A 467 11.808 12.116 -14.238 1.00 0.00 H new ATOM 0 HB3 LEU A 467 10.630 13.129 -13.428 1.00 0.00 H new ATOM 0 HG LEU A 467 12.192 12.000 -11.870 1.00 0.00 H new ATOM 0 HD11 LEU A 467 10.482 11.182 -10.298 1.00 0.00 H new ATOM 0 HD12 LEU A 467 9.975 12.688 -11.101 1.00 0.00 H new ATOM 0 HD13 LEU A 467 9.296 11.128 -11.624 1.00 0.00 H new ATOM 0 HD21 LEU A 467 11.959 9.582 -11.464 1.00 0.00 H new ATOM 0 HD22 LEU A 467 10.829 9.465 -12.834 1.00 0.00 H new ATOM 0 HD23 LEU A 467 12.526 9.922 -13.116 1.00 0.00 H new ATOM 982 N PRO A 468 7.527 12.319 -14.283 1.00 0.00 N ATOM 983 CA PRO A 468 6.453 13.234 -14.673 1.00 0.00 C ATOM 984 C PRO A 468 6.643 14.632 -14.098 1.00 0.00 C ATOM 985 O PRO A 468 6.021 14.995 -13.098 1.00 0.00 O ATOM 986 CB PRO A 468 5.203 12.578 -14.093 1.00 0.00 C ATOM 987 CG PRO A 468 5.692 11.809 -12.916 1.00 0.00 C ATOM 988 CD PRO A 468 7.084 11.352 -13.260 1.00 0.00 C ATOM 0 HA PRO A 468 6.411 13.379 -15.753 1.00 0.00 H new ATOM 0 HB2 PRO A 468 4.464 13.324 -13.800 1.00 0.00 H new ATOM 0 HB3 PRO A 468 4.724 11.924 -14.822 1.00 0.00 H new ATOM 0 HG2 PRO A 468 5.697 12.430 -12.020 1.00 0.00 H new ATOM 0 HG3 PRO A 468 5.043 10.958 -12.710 1.00 0.00 H new ATOM 0 HD2 PRO A 468 7.737 11.365 -12.387 1.00 0.00 H new ATOM 0 HD3 PRO A 468 7.087 10.332 -13.645 1.00 0.00 H new ATOM 996 N ALA A 469 7.507 15.410 -14.737 1.00 0.00 N ATOM 997 CA ALA A 469 7.788 16.773 -14.296 1.00 0.00 C ATOM 998 C ALA A 469 8.133 16.815 -12.809 1.00 0.00 C ATOM 999 O ALA A 469 7.455 17.551 -12.062 1.00 0.00 O ATOM 1000 CB ALA A 469 6.600 17.677 -14.598 1.00 0.00 C ATOM 1001 OXT ALA A 469 9.080 16.108 -12.404 1.00 0.00 O ATOM 0 H ALA A 469 8.028 15.121 -15.565 1.00 0.00 H new ATOM 0 HA ALA A 469 8.656 17.136 -14.846 1.00 0.00 H new ATOM 0 HB1 ALA A 469 6.821 18.691 -14.265 1.00 0.00 H new ATOM 0 HB2 ALA A 469 6.409 17.681 -15.671 1.00 0.00 H new ATOM 0 HB3 ALA A 469 5.719 17.307 -14.074 1.00 0.00 H new TER 1007 ALA A 469 ATOM 1008 O5' DC B 3 -4.538 14.384 -10.331 1.00 0.00 O ATOM 1009 C5' DC B 3 -5.685 13.533 -10.182 1.00 0.00 C ATOM 1010 C4' DC B 3 -5.687 12.855 -8.832 1.00 0.00 C ATOM 1011 O4' DC B 3 -6.640 13.509 -7.975 1.00 0.00 O ATOM 1012 C3' DC B 3 -6.111 11.388 -8.847 1.00 0.00 C ATOM 1013 O3' DC B 3 -4.959 10.542 -8.924 1.00 0.00 O ATOM 1014 C2' DC B 3 -6.823 11.197 -7.514 1.00 0.00 C ATOM 1015 C1' DC B 3 -7.015 12.606 -6.952 1.00 0.00 C ATOM 1016 N1 DC B 3 -8.395 12.923 -6.556 1.00 0.00 N ATOM 1017 C2 DC B 3 -8.603 13.738 -5.443 1.00 0.00 C ATOM 1018 O2 DC B 3 -7.619 14.166 -4.822 1.00 0.00 O ATOM 1019 N3 DC B 3 -9.867 14.038 -5.070 1.00 0.00 N ATOM 1020 C4 DC B 3 -10.899 13.555 -5.766 1.00 0.00 C ATOM 1021 N4 DC B 3 -12.131 13.878 -5.363 1.00 0.00 N ATOM 1022 C5 DC B 3 -10.716 12.720 -6.906 1.00 0.00 C ATOM 1023 C6 DC B 3 -9.457 12.431 -7.261 1.00 0.00 C ATOM 0 H5' DC B 3 -5.688 12.780 -10.970 1.00 0.00 H new ATOM 0 H5'' DC B 3 -6.595 14.121 -10.299 1.00 0.00 H new ATOM 0 H4' DC B 3 -4.653 12.918 -8.493 1.00 0.00 H new ATOM 0 H3' DC B 3 -6.742 11.137 -9.700 1.00 0.00 H new ATOM 0 H2' DC B 3 -7.780 10.694 -7.648 1.00 0.00 H new ATOM 0 H2'' DC B 3 -6.231 10.581 -6.837 1.00 0.00 H new ATOM 0 HO5' DC B 3 -4.559 14.810 -11.213 1.00 0.00 H new ATOM 0 H1' DC B 3 -6.411 12.681 -6.048 1.00 0.00 H new ATOM 0 H41 DC B 3 -12.942 13.527 -5.871 1.00 0.00 H new ATOM 0 H42 DC B 3 -12.260 14.476 -4.547 1.00 0.00 H new ATOM 0 H5 DC B 3 -11.559 12.336 -7.462 1.00 0.00 H new ATOM 0 H6 DC B 3 -9.279 11.799 -8.118 1.00 0.00 H new ATOM 1035 P DC B 4 -5.068 9.005 -8.469 1.00 0.00 P ATOM 1036 OP1 DC B 4 -3.937 8.274 -9.098 1.00 0.00 O ATOM 1037 OP2 DC B 4 -6.459 8.545 -8.703 1.00 0.00 O ATOM 1038 O5' DC B 4 -4.813 9.050 -6.898 1.00 0.00 O ATOM 1039 C5' DC B 4 -3.559 9.483 -6.370 1.00 0.00 C ATOM 1040 C4' DC B 4 -3.701 9.829 -4.906 1.00 0.00 C ATOM 1041 O4' DC B 4 -4.993 10.450 -4.695 1.00 0.00 O ATOM 1042 C3' DC B 4 -3.653 8.633 -3.956 1.00 0.00 C ATOM 1043 O3' DC B 4 -3.014 8.996 -2.730 1.00 0.00 O ATOM 1044 C2' DC B 4 -5.119 8.315 -3.723 1.00 0.00 C ATOM 1045 C1' DC B 4 -5.756 9.692 -3.770 1.00 0.00 C ATOM 1046 N1 DC B 4 -7.154 9.702 -4.221 1.00 0.00 N ATOM 1047 C2 DC B 4 -8.110 10.354 -3.439 1.00 0.00 C ATOM 1048 O2 DC B 4 -7.748 10.908 -2.391 1.00 0.00 O ATOM 1049 N3 DC B 4 -9.400 10.368 -3.845 1.00 0.00 N ATOM 1050 C4 DC B 4 -9.748 9.761 -4.981 1.00 0.00 C ATOM 1051 N4 DC B 4 -11.033 9.799 -5.343 1.00 0.00 N ATOM 1052 C5 DC B 4 -8.794 9.088 -5.800 1.00 0.00 C ATOM 1053 C6 DC B 4 -7.522 9.083 -5.385 1.00 0.00 C ATOM 0 H5' DC B 4 -3.203 10.352 -6.924 1.00 0.00 H new ATOM 0 H5'' DC B 4 -2.813 8.698 -6.495 1.00 0.00 H new ATOM 0 H4' DC B 4 -2.852 10.475 -4.683 1.00 0.00 H new ATOM 0 H3' DC B 4 -3.091 7.788 -4.354 1.00 0.00 H new ATOM 0 H2' DC B 4 -5.520 7.654 -4.492 1.00 0.00 H new ATOM 0 H2'' DC B 4 -5.282 7.823 -2.764 1.00 0.00 H new ATOM 0 H1' DC B 4 -5.762 10.092 -2.756 1.00 0.00 H new ATOM 0 H41 DC B 4 -11.333 9.345 -6.206 1.00 0.00 H new ATOM 0 H42 DC B 4 -11.714 10.282 -4.757 1.00 0.00 H new ATOM 0 H5 DC B 4 -9.087 8.602 -6.719 1.00 0.00 H new ATOM 0 H6 DC B 4 -6.772 8.582 -5.979 1.00 0.00 H new ATOM 1065 P DT B 5 -2.685 7.864 -1.637 1.00 0.00 P ATOM 1066 OP1 DT B 5 -1.235 7.950 -1.328 1.00 0.00 O ATOM 1067 OP2 DT B 5 -3.258 6.579 -2.110 1.00 0.00 O ATOM 1068 O5' DT B 5 -3.495 8.327 -0.345 1.00 0.00 O ATOM 1069 C5' DT B 5 -3.521 9.697 0.049 1.00 0.00 C ATOM 1070 C4' DT B 5 -4.417 9.877 1.252 1.00 0.00 C ATOM 1071 O4' DT B 5 -5.798 9.787 0.827 1.00 0.00 O ATOM 1072 C3' DT B 5 -4.254 8.819 2.342 1.00 0.00 C ATOM 1073 O3' DT B 5 -4.520 9.385 3.628 1.00 0.00 O ATOM 1074 C2' DT B 5 -5.305 7.787 1.981 1.00 0.00 C ATOM 1075 C1' DT B 5 -6.418 8.637 1.388 1.00 0.00 C ATOM 1076 N1 DT B 5 -7.192 7.978 0.319 1.00 0.00 N ATOM 1077 C2 DT B 5 -8.551 8.188 0.283 1.00 0.00 C ATOM 1078 O2 DT B 5 -9.141 8.883 1.094 1.00 0.00 O ATOM 1079 N3 DT B 5 -9.200 7.550 -0.743 1.00 0.00 N ATOM 1080 C4 DT B 5 -8.637 6.744 -1.712 1.00 0.00 C ATOM 1081 O4 DT B 5 -9.348 6.245 -2.580 1.00 0.00 O ATOM 1082 C5 DT B 5 -7.207 6.563 -1.609 1.00 0.00 C ATOM 1083 C7 DT B 5 -6.515 5.699 -2.615 1.00 0.59 C ATOM 1084 C6 DT B 5 -6.559 7.180 -0.612 1.00 0.00 C ATOM 0 H5' DT B 5 -3.879 10.313 -0.776 1.00 0.00 H new ATOM 0 H5'' DT B 5 -2.512 10.034 0.284 1.00 0.00 H new ATOM 0 H4' DT B 5 -4.136 10.844 1.669 1.00 0.00 H new ATOM 0 H3' DT B 5 -3.248 8.403 2.395 1.00 0.00 H new ATOM 0 H2' DT B 5 -4.927 7.058 1.265 1.00 0.00 H new ATOM 0 H2'' DT B 5 -5.643 7.230 2.855 1.00 0.00 H new ATOM 0 H1' DT B 5 -7.125 8.853 2.189 1.00 0.00 H new ATOM 0 H3 DT B 5 -10.210 7.686 -0.796 1.00 0.00 H new ATOM 0 H71 DT B 5 -5.495 6.054 -2.759 1.00 0.59 H new ATOM 0 H72 DT B 5 -6.494 4.670 -2.257 1.00 0.59 H new ATOM 0 H73 DT B 5 -7.052 5.743 -3.563 1.00 0.59 H new ATOM 0 H6 DT B 5 -5.490 7.047 -0.533 1.00 0.00 H new ATOM 1097 P DT B 6 -3.646 8.930 4.897 1.00 0.00 P ATOM 1098 OP1 DT B 6 -3.620 10.067 5.851 1.00 0.00 O ATOM 1099 OP2 DT B 6 -2.369 8.359 4.402 1.00 0.00 O ATOM 1100 O5' DT B 6 -4.500 7.754 5.551 1.00 0.00 O ATOM 1101 C5' DT B 6 -5.489 8.034 6.541 1.00 0.00 C ATOM 1102 C4' DT B 6 -6.474 6.891 6.630 1.00 0.00 C ATOM 1103 O4' DT B 6 -7.210 6.807 5.395 1.00 0.00 O ATOM 1104 C3' DT B 6 -5.847 5.508 6.825 1.00 0.00 C ATOM 1105 O3' DT B 6 -5.983 5.097 8.188 1.00 0.00 O ATOM 1106 C2' DT B 6 -6.651 4.591 5.911 1.00 0.00 C ATOM 1107 C1' DT B 6 -7.700 5.490 5.273 1.00 0.00 C ATOM 1108 N1 DT B 6 -7.957 5.233 3.844 1.00 0.00 N ATOM 1109 C2 DT B 6 -9.261 5.282 3.408 1.00 0.00 C ATOM 1110 O2 DT B 6 -10.202 5.521 4.148 1.00 0.00 O ATOM 1111 N3 DT B 6 -9.426 5.042 2.069 1.00 0.00 N ATOM 1112 C4 DT B 6 -8.442 4.756 1.145 1.00 0.00 C ATOM 1113 O4 DT B 6 -8.743 4.552 -0.027 1.00 0.00 O ATOM 1114 C5 DT B 6 -7.095 4.718 1.672 1.00 0.00 C ATOM 1115 C7 DT B 6 -5.964 4.426 0.738 1.00 0.59 C ATOM 1116 C6 DT B 6 -6.919 4.955 2.980 1.00 0.00 C ATOM 0 H5' DT B 6 -6.013 8.957 6.292 1.00 0.00 H new ATOM 0 H5'' DT B 6 -5.012 8.189 7.509 1.00 0.00 H new ATOM 0 H4' DT B 6 -7.084 7.119 7.504 1.00 0.00 H new ATOM 0 H3' DT B 6 -4.782 5.493 6.592 1.00 0.00 H new ATOM 0 H2' DT B 6 -6.014 4.130 5.156 1.00 0.00 H new ATOM 0 H2'' DT B 6 -7.115 3.781 6.474 1.00 0.00 H new ATOM 0 H1' DT B 6 -8.646 5.305 5.781 1.00 0.00 H new ATOM 0 H3 DT B 6 -10.382 5.079 1.716 1.00 0.00 H new ATOM 0 H71 DT B 6 -6.316 3.784 -0.070 1.00 0.59 H new ATOM 0 H72 DT B 6 -5.586 5.360 0.321 1.00 0.59 H new ATOM 0 H73 DT B 6 -5.165 3.921 1.281 1.00 0.59 H new ATOM 0 H6 DT B 6 -5.915 4.927 3.376 1.00 0.00 H new ATOM 1129 P DT B 7 -5.141 3.839 8.727 1.00 0.00 P ATOM 1130 OP1 DT B 7 -4.752 4.132 10.129 1.00 0.00 O ATOM 1131 OP2 DT B 7 -4.092 3.515 7.726 1.00 0.00 O ATOM 1132 O5' DT B 7 -6.198 2.647 8.746 1.00 0.00 O ATOM 1133 C5' DT B 7 -7.211 2.583 9.749 1.00 0.00 C ATOM 1134 C4' DT B 7 -8.433 1.878 9.211 1.00 0.00 C ATOM 1135 O4' DT B 7 -8.586 2.212 7.811 1.00 0.00 O ATOM 1136 C3' DT B 7 -8.376 0.348 9.287 1.00 0.00 C ATOM 1137 O3' DT B 7 -9.538 -0.153 9.954 1.00 0.00 O ATOM 1138 C2' DT B 7 -8.354 -0.107 7.835 1.00 0.00 C ATOM 1139 C1' DT B 7 -8.972 1.060 7.095 1.00 0.00 C ATOM 1140 N1 DT B 7 -8.515 1.218 5.702 1.00 0.00 N ATOM 1141 C2 DT B 7 -9.453 1.139 4.698 1.00 0.00 C ATOM 1142 O2 DT B 7 -10.638 0.945 4.908 1.00 0.00 O ATOM 1143 N3 DT B 7 -8.950 1.296 3.432 1.00 0.00 N ATOM 1144 C4 DT B 7 -7.635 1.521 3.081 1.00 0.00 C ATOM 1145 O4 DT B 7 -7.331 1.648 1.897 1.00 0.00 O ATOM 1146 C5 DT B 7 -6.705 1.590 4.183 1.00 0.00 C ATOM 1147 C7 DT B 7 -5.256 1.826 3.894 1.00 0.59 C ATOM 1148 C6 DT B 7 -7.181 1.437 5.427 1.00 0.00 C ATOM 0 H5' DT B 7 -7.476 3.589 10.073 1.00 0.00 H new ATOM 0 H5'' DT B 7 -6.833 2.055 10.625 1.00 0.00 H new ATOM 0 H4' DT B 7 -9.260 2.213 9.837 1.00 0.00 H new ATOM 0 H3' DT B 7 -7.511 -0.013 9.844 1.00 0.00 H new ATOM 0 H2' DT B 7 -7.339 -0.309 7.492 1.00 0.00 H new ATOM 0 H2'' DT B 7 -8.927 -1.023 7.692 1.00 0.00 H new ATOM 0 H1' DT B 7 -10.048 0.894 7.039 1.00 0.00 H new ATOM 0 H3 DT B 7 -9.621 1.240 2.666 1.00 0.00 H new ATOM 0 H71 DT B 7 -5.006 1.405 2.920 1.00 0.59 H new ATOM 0 H72 DT B 7 -5.056 2.897 3.889 1.00 0.59 H new ATOM 0 H73 DT B 7 -4.649 1.347 4.662 1.00 0.59 H new ATOM 0 H6 DT B 7 -6.487 1.488 6.253 1.00 0.00 H new ATOM 1161 P DG B 8 -9.534 -1.646 10.546 1.00 0.00 P ATOM 1162 OP1 DG B 8 -9.895 -1.558 11.983 1.00 0.00 O ATOM 1163 OP2 DG B 8 -8.264 -2.304 10.147 1.00 0.00 O ATOM 1164 O5' DG B 8 -10.732 -2.366 9.778 1.00 0.00 O ATOM 1165 C5' DG B 8 -12.070 -1.888 9.900 1.00 0.00 C ATOM 1166 C4' DG B 8 -13.001 -2.724 9.053 1.00 0.00 C ATOM 1167 O4' DG B 8 -12.601 -2.614 7.666 1.00 0.00 O ATOM 1168 C3' DG B 8 -12.978 -4.218 9.363 1.00 0.00 C ATOM 1169 O3' DG B 8 -14.241 -4.813 9.047 1.00 0.00 O ATOM 1170 C2' DG B 8 -11.893 -4.732 8.437 1.00 0.00 C ATOM 1171 C1' DG B 8 -12.071 -3.852 7.209 1.00 0.00 C ATOM 1172 N9 DG B 8 -10.832 -3.571 6.491 1.00 0.00 N ATOM 1173 C8 DG B 8 -9.583 -3.402 7.034 1.00 0.00 C ATOM 1174 N7 DG B 8 -8.661 -3.166 6.142 1.00 0.00 N ATOM 1175 C5 DG B 8 -9.345 -3.179 4.934 1.00 0.00 C ATOM 1176 C6 DG B 8 -8.873 -2.982 3.610 1.00 0.00 C ATOM 1177 O6 DG B 8 -7.719 -2.750 3.232 1.00 0.00 O ATOM 1178 N1 DG B 8 -9.903 -3.078 2.681 1.00 0.00 N ATOM 1179 C2 DG B 8 -11.220 -3.329 2.985 1.00 0.00 C ATOM 1180 N2 DG B 8 -12.067 -3.382 1.946 1.00 0.00 N ATOM 1181 N3 DG B 8 -11.672 -3.514 4.214 1.00 0.00 N ATOM 1182 C4 DG B 8 -10.687 -3.426 5.132 1.00 0.00 C ATOM 0 H5' DG B 8 -12.121 -0.845 9.589 1.00 0.00 H new ATOM 0 H5'' DG B 8 -12.384 -1.925 10.943 1.00 0.00 H new ATOM 0 H4' DG B 8 -13.998 -2.340 9.267 1.00 0.00 H new ATOM 0 H3' DG B 8 -12.794 -4.446 10.413 1.00 0.00 H new ATOM 0 H2' DG B 8 -10.900 -4.624 8.874 1.00 0.00 H new ATOM 0 H2'' DG B 8 -12.025 -5.788 8.203 1.00 0.00 H new ATOM 0 H1' DG B 8 -12.720 -4.382 6.512 1.00 0.00 H new ATOM 0 H8 DG B 8 -9.383 -3.459 8.094 1.00 0.00 H new ATOM 0 H1 DG B 8 -9.663 -2.952 1.698 1.00 0.00 H new ATOM 0 H21 DG B 8 -13.058 -3.565 2.105 1.00 0.00 H new ATOM 0 H22 DG B 8 -11.720 -3.240 0.997 1.00 0.00 H new ATOM 1194 P DA B 9 -14.471 -6.379 9.316 1.00 0.00 P ATOM 1195 OP1 DA B 9 -15.701 -6.512 10.137 1.00 0.00 O ATOM 1196 OP2 DA B 9 -13.197 -6.963 9.805 1.00 0.00 O ATOM 1197 O5' DA B 9 -14.774 -6.979 7.871 1.00 0.00 O ATOM 1198 C5' DA B 9 -15.939 -6.591 7.144 1.00 0.00 C ATOM 1199 C4' DA B 9 -16.036 -7.374 5.857 1.00 0.00 C ATOM 1200 O4' DA B 9 -14.844 -7.133 5.072 1.00 0.00 O ATOM 1201 C3' DA B 9 -16.108 -8.889 6.033 1.00 0.00 C ATOM 1202 O3' DA B 9 -16.847 -9.484 4.960 1.00 0.00 O ATOM 1203 C2' DA B 9 -14.650 -9.305 5.982 1.00 0.00 C ATOM 1204 C1' DA B 9 -14.063 -8.318 4.985 1.00 0.00 C ATOM 1205 N9 DA B 9 -12.670 -7.959 5.252 1.00 0.00 N ATOM 1206 C8 DA B 9 -12.059 -7.838 6.474 1.00 0.00 C ATOM 1207 N7 DA B 9 -10.793 -7.504 6.401 1.00 0.00 N ATOM 1208 C5 DA B 9 -10.555 -7.399 5.038 1.00 0.00 C ATOM 1209 C6 DA B 9 -9.402 -7.077 4.301 1.00 0.00 C ATOM 1210 N6 DA B 9 -8.223 -6.789 4.857 1.00 0.00 N ATOM 1211 N1 DA B 9 -9.502 -7.062 2.954 1.00 0.00 N ATOM 1212 C2 DA B 9 -10.684 -7.352 2.395 1.00 0.00 C ATOM 1213 N3 DA B 9 -11.836 -7.671 2.981 1.00 0.00 N ATOM 1214 C4 DA B 9 -11.703 -7.677 4.319 1.00 0.00 C ATOM 0 H5' DA B 9 -15.902 -5.524 6.927 1.00 0.00 H new ATOM 0 H5'' DA B 9 -16.829 -6.762 7.750 1.00 0.00 H new ATOM 0 H4' DA B 9 -16.961 -7.036 5.389 1.00 0.00 H new ATOM 0 H3' DA B 9 -16.610 -9.198 6.950 1.00 0.00 H new ATOM 0 H2' DA B 9 -14.172 -9.229 6.958 1.00 0.00 H new ATOM 0 H2'' DA B 9 -14.533 -10.336 5.649 1.00 0.00 H new ATOM 0 H1' DA B 9 -14.081 -8.788 4.002 1.00 0.00 H new ATOM 0 H8 DA B 9 -12.573 -8.003 7.410 1.00 0.00 H new ATOM 0 H61 DA B 9 -7.422 -6.563 4.267 1.00 0.00 H new ATOM 0 H62 DA B 9 -8.123 -6.795 5.872 1.00 0.00 H new ATOM 0 H2 DA B 9 -10.706 -7.323 1.316 1.00 0.00 H new ATOM 1226 P DC B 10 -17.029 -11.080 4.907 1.00 0.00 P ATOM 1227 OP1 DC B 10 -18.485 -11.356 4.819 1.00 0.00 O ATOM 1228 OP2 DC B 10 -16.233 -11.680 6.008 1.00 0.00 O ATOM 1229 O5' DC B 10 -16.365 -11.501 3.520 1.00 0.00 O ATOM 1230 C5' DC B 10 -17.141 -11.554 2.324 1.00 0.00 C ATOM 1231 C4' DC B 10 -16.329 -12.154 1.200 1.00 0.00 C ATOM 1232 O4' DC B 10 -14.967 -11.675 1.295 1.00 0.00 O ATOM 1233 C3' DC B 10 -16.236 -13.679 1.216 1.00 0.00 C ATOM 1234 O3' DC B 10 -16.174 -14.189 -0.119 1.00 0.00 O ATOM 1235 C2' DC B 10 -14.935 -13.943 1.951 1.00 0.00 C ATOM 1236 C1' DC B 10 -14.077 -12.747 1.573 1.00 0.00 C ATOM 1237 N1 DC B 10 -13.159 -12.304 2.634 1.00 0.00 N ATOM 1238 C2 DC B 10 -11.846 -11.967 2.294 1.00 0.00 C ATOM 1239 O2 DC B 10 -11.489 -12.054 1.105 1.00 0.00 O ATOM 1240 N3 DC B 10 -10.998 -11.555 3.265 1.00 0.00 N ATOM 1241 C4 DC B 10 -11.420 -11.475 4.529 1.00 0.00 C ATOM 1242 N4 DC B 10 -10.551 -11.063 5.456 1.00 0.00 N ATOM 1243 C5 DC B 10 -12.753 -11.814 4.902 1.00 0.00 C ATOM 1244 C6 DC B 10 -13.581 -12.219 3.931 1.00 0.00 C ATOM 0 H5' DC B 10 -17.469 -10.551 2.050 1.00 0.00 H new ATOM 0 H5'' DC B 10 -18.039 -12.149 2.491 1.00 0.00 H new ATOM 0 H4' DC B 10 -16.846 -11.854 0.288 1.00 0.00 H new ATOM 0 H3' DC B 10 -17.095 -14.157 1.686 1.00 0.00 H new ATOM 0 H2' DC B 10 -15.086 -14.006 3.029 1.00 0.00 H new ATOM 0 H2'' DC B 10 -14.478 -14.882 1.638 1.00 0.00 H new ATOM 0 H1' DC B 10 -13.457 -13.041 0.726 1.00 0.00 H new ATOM 0 H41 DC B 10 -10.842 -10.991 6.431 1.00 0.00 H new ATOM 0 H42 DC B 10 -9.597 -10.821 5.189 1.00 0.00 H new ATOM 0 H5 DC B 10 -13.083 -11.747 5.928 1.00 0.00 H new ATOM 0 H6 DC B 10 -14.599 -12.483 4.177 1.00 0.00 H new ATOM 1256 P DC B 11 -16.573 -15.720 -0.405 1.00 0.00 P ATOM 1257 OP1 DC B 11 -17.466 -15.732 -1.592 1.00 0.00 O ATOM 1258 OP2 DC B 11 -17.038 -16.326 0.868 1.00 0.00 O ATOM 1259 O5' DC B 11 -15.196 -16.407 -0.813 1.00 0.00 O ATOM 1260 C5' DC B 11 -14.642 -16.222 -2.114 1.00 0.00 C ATOM 1261 C4' DC B 11 -13.290 -16.888 -2.205 1.00 0.00 C ATOM 1262 O4' DC B 11 -12.387 -16.241 -1.273 1.00 0.00 O ATOM 1263 C3' DC B 11 -13.279 -18.374 -1.839 1.00 0.00 C ATOM 1264 O3' DC B 11 -12.394 -19.091 -2.705 1.00 0.00 O ATOM 1265 C2' DC B 11 -12.758 -18.386 -0.414 1.00 0.00 C ATOM 1266 C1' DC B 11 -11.804 -17.209 -0.418 1.00 0.00 C ATOM 1267 N1 DC B 11 -11.583 -16.578 0.894 1.00 0.00 N ATOM 1268 C2 DC B 11 -10.308 -16.101 1.201 1.00 0.00 C ATOM 1269 O2 DC B 11 -9.404 -16.222 0.358 1.00 0.00 O ATOM 1270 N3 DC B 11 -10.089 -15.520 2.402 1.00 0.00 N ATOM 1271 C4 DC B 11 -11.087 -15.409 3.281 1.00 0.00 C ATOM 1272 N4 DC B 11 -10.827 -14.830 4.457 1.00 0.00 N ATOM 1273 C5 DC B 11 -12.400 -15.888 2.995 1.00 0.00 C ATOM 1274 C6 DC B 11 -12.601 -16.460 1.801 1.00 0.00 C ATOM 0 H5' DC B 11 -14.546 -15.158 -2.328 1.00 0.00 H new ATOM 0 H5'' DC B 11 -15.312 -16.639 -2.865 1.00 0.00 H new ATOM 0 H4' DC B 11 -12.995 -16.795 -3.250 1.00 0.00 H new ATOM 0 H3' DC B 11 -14.256 -18.847 -1.936 1.00 0.00 H new ATOM 0 H2' DC B 11 -13.559 -18.260 0.314 1.00 0.00 H new ATOM 0 H2'' DC B 11 -12.252 -19.321 -0.172 1.00 0.00 H new ATOM 0 H1' DC B 11 -10.828 -17.576 -0.736 1.00 0.00 H new ATOM 0 H41 DC B 11 -11.568 -14.730 5.151 1.00 0.00 H new ATOM 0 H42 DC B 11 -9.888 -14.488 4.661 1.00 0.00 H new ATOM 0 H5 DC B 11 -13.201 -15.793 3.713 1.00 0.00 H new ATOM 0 H6 DC B 11 -13.582 -16.834 1.550 1.00 0.00 H new ATOM 1286 P DA B 12 -12.418 -20.698 -2.714 1.00 0.00 P ATOM 1287 OP1 DA B 12 -12.619 -21.129 -4.122 1.00 0.00 O ATOM 1288 OP2 DA B 12 -13.363 -21.159 -1.665 1.00 0.00 O ATOM 1289 O5' DA B 12 -10.944 -21.109 -2.277 1.00 0.00 O ATOM 1290 C5' DA B 12 -9.826 -20.836 -3.120 1.00 0.00 C ATOM 1291 C4' DA B 12 -8.549 -21.309 -2.463 1.00 0.00 C ATOM 1292 O4' DA B 12 -8.326 -20.533 -1.261 1.00 0.00 O ATOM 1293 C3' DA B 12 -8.562 -22.769 -2.013 1.00 0.00 C ATOM 1294 O3' DA B 12 -7.247 -23.343 -2.074 1.00 0.00 O ATOM 1295 C2' DA B 12 -9.028 -22.676 -0.572 1.00 0.00 C ATOM 1296 C1' DA B 12 -8.411 -21.366 -0.112 1.00 0.00 C ATOM 1297 N9 DA B 12 -9.190 -20.654 0.901 1.00 0.00 N ATOM 1298 C8 DA B 12 -10.555 -20.627 1.046 1.00 0.00 C ATOM 1299 N7 DA B 12 -10.964 -19.895 2.054 1.00 0.00 N ATOM 1300 C5 DA B 12 -9.790 -19.409 2.612 1.00 0.00 C ATOM 1301 C6 DA B 12 -9.540 -18.569 3.711 1.00 0.00 C ATOM 1302 N6 DA B 12 -10.500 -18.048 4.480 1.00 0.00 N ATOM 1303 N1 DA B 12 -8.253 -18.277 3.999 1.00 0.00 N ATOM 1304 C2 DA B 12 -7.291 -18.799 3.229 1.00 0.00 C ATOM 1305 N3 DA B 12 -7.398 -19.600 2.171 1.00 0.00 N ATOM 1306 C4 DA B 12 -8.689 -19.870 1.911 1.00 0.00 C ATOM 0 H5' DA B 12 -9.766 -19.766 -3.321 1.00 0.00 H new ATOM 0 H5'' DA B 12 -9.955 -21.334 -4.081 1.00 0.00 H new ATOM 0 H4' DA B 12 -7.778 -21.191 -3.224 1.00 0.00 H new ATOM 0 H3' DA B 12 -9.193 -23.400 -2.639 1.00 0.00 H new ATOM 0 H2' DA B 12 -10.115 -22.661 -0.497 1.00 0.00 H new ATOM 0 H2'' DA B 12 -8.679 -23.520 0.023 1.00 0.00 H new ATOM 0 HO3' DA B 12 -7.284 -24.277 -1.779 1.00 0.00 H new ATOM 0 H1' DA B 12 -7.449 -21.596 0.346 1.00 0.00 H new ATOM 0 H8 DA B 12 -11.229 -21.159 0.391 1.00 0.00 H new ATOM 0 H61 DA B 12 -10.254 -17.444 5.264 1.00 0.00 H new ATOM 0 H62 DA B 12 -11.479 -18.254 4.283 1.00 0.00 H new ATOM 0 H2 DA B 12 -6.282 -18.532 3.506 1.00 0.00 H new TER 1318 DA B 12 ATOM 1319 O5' DT C 21 -0.739 -18.568 9.126 1.00 0.00 O ATOM 1320 C5' DT C 21 -1.689 -17.500 9.278 1.00 0.00 C ATOM 1321 C4' DT C 21 -1.880 -16.753 7.980 1.00 0.00 C ATOM 1322 O4' DT C 21 -3.117 -17.172 7.371 1.00 0.00 O ATOM 1323 C3' DT C 21 -2.002 -15.239 8.119 1.00 0.00 C ATOM 1324 O3' DT C 21 -0.710 -14.632 8.002 1.00 0.00 O ATOM 1325 C2' DT C 21 -2.899 -14.844 6.955 1.00 0.00 C ATOM 1326 C1' DT C 21 -3.603 -16.135 6.533 1.00 0.00 C ATOM 1327 N1 DT C 21 -5.070 -16.102 6.666 1.00 0.00 N ATOM 1328 C2 DT C 21 -5.819 -16.824 5.764 1.00 0.00 C ATOM 1329 O2 DT C 21 -5.322 -17.473 4.858 1.00 0.00 O ATOM 1330 N3 DT C 21 -7.174 -16.756 5.961 1.00 0.00 N ATOM 1331 C4 DT C 21 -7.838 -16.048 6.941 1.00 0.00 C ATOM 1332 O4 DT C 21 -9.065 -16.080 6.991 1.00 0.00 O ATOM 1333 C5 DT C 21 -6.992 -15.312 7.851 1.00 0.00 C ATOM 1334 C7 DT C 21 -7.629 -14.524 8.953 1.00 0.59 C ATOM 1335 C6 DT C 21 -5.665 -15.371 7.675 1.00 0.00 C ATOM 0 H5' DT C 21 -1.346 -16.811 10.050 1.00 0.00 H new ATOM 0 H5'' DT C 21 -2.644 -17.904 9.613 1.00 0.00 H new ATOM 0 H4' DT C 21 -0.987 -16.981 7.399 1.00 0.00 H new ATOM 0 H3' DT C 21 -2.405 -14.922 9.081 1.00 0.00 H new ATOM 0 H2' DT C 21 -3.619 -14.083 7.254 1.00 0.00 H new ATOM 0 H2'' DT C 21 -2.317 -14.427 6.133 1.00 0.00 H new ATOM 0 HO5' DT C 21 -0.632 -19.035 9.981 1.00 0.00 H new ATOM 0 H1' DT C 21 -3.389 -16.285 5.475 1.00 0.00 H new ATOM 0 H3 DT C 21 -7.755 -17.287 5.312 1.00 0.00 H new ATOM 0 H71 DT C 21 -6.954 -14.483 9.808 1.00 0.59 H new ATOM 0 H72 DT C 21 -7.835 -13.512 8.605 1.00 0.59 H new ATOM 0 H73 DT C 21 -8.562 -15.002 9.250 1.00 0.59 H new ATOM 0 H6 DT C 21 -5.031 -14.821 8.354 1.00 0.00 H new ATOM 1348 P DG C 22 -0.580 -13.133 7.437 1.00 0.00 P ATOM 1349 OP1 DG C 22 0.853 -12.753 7.513 1.00 0.00 O ATOM 1350 OP2 DG C 22 -1.600 -12.289 8.108 1.00 0.00 O ATOM 1351 O5' DG C 22 -0.975 -13.265 5.899 1.00 0.00 O ATOM 1352 C5' DG C 22 -0.158 -14.005 4.991 1.00 0.00 C ATOM 1353 C4' DG C 22 -0.474 -13.606 3.569 1.00 0.00 C ATOM 1354 O4' DG C 22 -1.683 -14.290 3.155 1.00 0.00 O ATOM 1355 C3' DG C 22 -0.738 -12.114 3.373 1.00 0.00 C ATOM 1356 O3' DG C 22 0.401 -11.465 2.804 1.00 0.00 O ATOM 1357 C2' DG C 22 -1.890 -12.072 2.389 1.00 0.00 C ATOM 1358 C1' DG C 22 -2.629 -13.368 2.639 1.00 0.00 C ATOM 1359 N9 DG C 22 -3.724 -13.257 3.597 1.00 0.00 N ATOM 1360 C8 DG C 22 -3.672 -12.697 4.848 1.00 0.00 C ATOM 1361 N7 DG C 22 -4.815 -12.740 5.479 1.00 0.00 N ATOM 1362 C5 DG C 22 -5.675 -13.365 4.585 1.00 0.00 C ATOM 1363 C6 DG C 22 -7.051 -13.692 4.706 1.00 0.00 C ATOM 1364 O6 DG C 22 -7.814 -13.485 5.658 1.00 0.00 O ATOM 1365 N1 DG C 22 -7.528 -14.322 3.561 1.00 0.00 N ATOM 1366 C2 DG C 22 -6.782 -14.601 2.444 1.00 0.00 C ATOM 1367 N2 DG C 22 -7.432 -15.211 1.444 1.00 0.00 N ATOM 1368 N3 DG C 22 -5.500 -14.304 2.318 1.00 0.00 N ATOM 1369 C4 DG C 22 -5.014 -13.691 3.418 1.00 0.00 C ATOM 0 H5' DG C 22 -0.328 -15.073 5.124 1.00 0.00 H new ATOM 0 H5'' DG C 22 0.895 -13.821 5.204 1.00 0.00 H new ATOM 0 H4' DG C 22 0.408 -13.872 2.986 1.00 0.00 H new ATOM 0 H3' DG C 22 -0.953 -11.608 4.314 1.00 0.00 H new ATOM 0 H2' DG C 22 -2.531 -11.207 2.561 1.00 0.00 H new ATOM 0 H2'' DG C 22 -1.535 -12.006 1.361 1.00 0.00 H new ATOM 0 H1' DG C 22 -3.076 -13.680 1.695 1.00 0.00 H new ATOM 0 H8 DG C 22 -2.776 -12.264 5.269 1.00 0.00 H new ATOM 0 H1 DG C 22 -8.510 -14.598 3.551 1.00 0.00 H new ATOM 0 H21 DG C 22 -6.938 -15.448 0.584 1.00 0.00 H new ATOM 0 H22 DG C 22 -8.421 -15.439 1.543 1.00 0.00 H new ATOM 1381 P DG C 23 0.306 -9.918 2.382 1.00 0.00 P ATOM 1382 OP1 DG C 23 1.575 -9.563 1.696 1.00 0.00 O ATOM 1383 OP2 DG C 23 -0.127 -9.143 3.571 1.00 0.00 O ATOM 1384 O5' DG C 23 -0.868 -9.877 1.305 1.00 0.00 O ATOM 1385 C5' DG C 23 -0.632 -10.243 -0.055 1.00 0.00 C ATOM 1386 C4' DG C 23 -1.943 -10.386 -0.795 1.00 0.00 C ATOM 1387 O4' DG C 23 -2.957 -10.860 0.125 1.00 0.00 O ATOM 1388 C3' DG C 23 -2.486 -9.088 -1.395 1.00 0.00 C ATOM 1389 O3' DG C 23 -3.021 -9.332 -2.701 1.00 0.00 O ATOM 1390 C2' DG C 23 -3.588 -8.676 -0.436 1.00 0.00 C ATOM 1391 C1' DG C 23 -4.087 -10.006 0.093 1.00 0.00 C ATOM 1392 N9 DG C 23 -4.644 -9.947 1.440 1.00 0.00 N ATOM 1393 C8 DG C 23 -3.986 -9.562 2.581 1.00 0.00 C ATOM 1394 N7 DG C 23 -4.734 -9.605 3.648 1.00 0.00 N ATOM 1395 C5 DG C 23 -5.964 -10.052 3.187 1.00 0.00 C ATOM 1396 C6 DG C 23 -7.171 -10.298 3.887 1.00 0.00 C ATOM 1397 O6 DG C 23 -7.401 -10.168 5.095 1.00 0.00 O ATOM 1398 N1 DG C 23 -8.176 -10.739 3.036 1.00 0.00 N ATOM 1399 C2 DG C 23 -8.040 -10.922 1.682 1.00 0.00 C ATOM 1400 N2 DG C 23 -9.137 -11.356 1.043 1.00 0.00 N ATOM 1401 N3 DG C 23 -6.919 -10.697 1.013 1.00 0.00 N ATOM 1402 C4 DG C 23 -5.928 -10.266 1.823 1.00 0.00 C ATOM 0 H5' DG C 23 -0.079 -11.182 -0.095 1.00 0.00 H new ATOM 0 H5'' DG C 23 -0.013 -9.488 -0.540 1.00 0.00 H new ATOM 0 H4' DG C 23 -1.733 -11.075 -1.613 1.00 0.00 H new ATOM 0 H3' DG C 23 -1.721 -8.320 -1.510 1.00 0.00 H new ATOM 0 H2' DG C 23 -3.211 -8.038 0.364 1.00 0.00 H new ATOM 0 H2'' DG C 23 -4.377 -8.120 -0.942 1.00 0.00 H new ATOM 0 H1' DG C 23 -4.895 -10.348 -0.554 1.00 0.00 H new ATOM 0 H8 DG C 23 -2.951 -9.254 2.594 1.00 0.00 H new ATOM 0 H1 DG C 23 -9.086 -10.943 3.449 1.00 0.00 H new ATOM 0 H21 DG C 23 -9.111 -11.515 0.036 1.00 0.00 H new ATOM 0 H22 DG C 23 -9.997 -11.527 1.565 1.00 0.00 H new ATOM 1414 P DT C 24 -2.545 -8.422 -3.937 1.00 0.00 P ATOM 1415 OP1 DT C 24 -2.400 -9.314 -5.117 1.00 0.00 O ATOM 1416 OP2 DT C 24 -1.390 -7.598 -3.495 1.00 0.00 O ATOM 1417 O5' DT C 24 -3.779 -7.451 -4.198 1.00 0.00 O ATOM 1418 C5' DT C 24 -4.832 -7.825 -5.087 1.00 0.00 C ATOM 1419 C4' DT C 24 -6.074 -7.019 -4.790 1.00 0.00 C ATOM 1420 O4' DT C 24 -6.606 -7.422 -3.511 1.00 0.00 O ATOM 1421 C3' DT C 24 -5.853 -5.517 -4.666 1.00 0.00 C ATOM 1422 O3' DT C 24 -6.008 -4.886 -5.940 1.00 0.00 O ATOM 1423 C2' DT C 24 -6.952 -5.077 -3.711 1.00 0.00 C ATOM 1424 C1' DT C 24 -7.331 -6.342 -2.939 1.00 0.00 C ATOM 1425 N1 DT C 24 -7.010 -6.295 -1.501 1.00 0.00 N ATOM 1426 C2 DT C 24 -8.016 -6.570 -0.603 1.00 0.00 C ATOM 1427 O2 DT C 24 -9.153 -6.856 -0.944 1.00 0.00 O ATOM 1428 N3 DT C 24 -7.643 -6.501 0.715 1.00 0.00 N ATOM 1429 C4 DT C 24 -6.391 -6.202 1.210 1.00 0.00 C ATOM 1430 O4 DT C 24 -6.200 -6.192 2.423 1.00 0.00 O ATOM 1431 C5 DT C 24 -5.383 -5.923 0.214 1.00 0.00 C ATOM 1432 C7 DT C 24 -4.001 -5.570 0.667 1.00 0.59 C ATOM 1433 C6 DT C 24 -5.734 -5.982 -1.079 1.00 0.00 C ATOM 0 H5' DT C 24 -5.046 -8.889 -4.982 1.00 0.00 H new ATOM 0 H5'' DT C 24 -4.522 -7.662 -6.119 1.00 0.00 H new ATOM 0 H4' DT C 24 -6.732 -7.209 -5.638 1.00 0.00 H new ATOM 0 H3' DT C 24 -4.855 -5.256 -4.314 1.00 0.00 H new ATOM 0 H2' DT C 24 -6.601 -4.294 -3.039 1.00 0.00 H new ATOM 0 H2'' DT C 24 -7.808 -4.673 -4.252 1.00 0.00 H new ATOM 0 H1' DT C 24 -8.413 -6.452 -3.015 1.00 0.00 H new ATOM 0 H3 DT C 24 -8.371 -6.692 1.404 1.00 0.00 H new ATOM 0 H71 DT C 24 -3.278 -5.900 -0.079 1.00 0.59 H new ATOM 0 H72 DT C 24 -3.924 -4.490 0.793 1.00 0.59 H new ATOM 0 H73 DT C 24 -3.793 -6.062 1.617 1.00 0.59 H new ATOM 0 H6 DT C 24 -4.982 -5.775 -1.826 1.00 0.00 H new ATOM 1446 P DC C 25 -6.255 -3.299 -6.019 1.00 0.00 P ATOM 1447 OP1 DC C 25 -5.955 -2.873 -7.409 1.00 0.00 O ATOM 1448 OP2 DC C 25 -5.544 -2.658 -4.885 1.00 0.00 O ATOM 1449 O5' DC C 25 -7.823 -3.142 -5.782 1.00 0.00 O ATOM 1450 C5' DC C 25 -8.759 -3.924 -6.522 1.00 0.00 C ATOM 1451 C4' DC C 25 -10.169 -3.592 -6.093 1.00 0.00 C ATOM 1452 O4' DC C 25 -10.288 -3.814 -4.667 1.00 0.00 O ATOM 1453 C3' DC C 25 -10.583 -2.140 -6.320 1.00 0.00 C ATOM 1454 O3' DC C 25 -11.984 -2.058 -6.598 1.00 0.00 O ATOM 1455 C2' DC C 25 -10.260 -1.478 -4.995 1.00 0.00 C ATOM 1456 C1' DC C 25 -10.526 -2.588 -3.992 1.00 0.00 C ATOM 1457 N1 DC C 25 -9.658 -2.550 -2.806 1.00 0.00 N ATOM 1458 C2 DC C 25 -10.225 -2.758 -1.547 1.00 0.00 C ATOM 1459 O2 DC C 25 -11.443 -2.974 -1.468 1.00 0.00 O ATOM 1460 N3 DC C 25 -9.433 -2.721 -0.452 1.00 0.00 N ATOM 1461 C4 DC C 25 -8.126 -2.484 -0.581 1.00 0.00 C ATOM 1462 N4 DC C 25 -7.383 -2.457 0.526 1.00 0.00 N ATOM 1463 C5 DC C 25 -7.520 -2.267 -1.853 1.00 0.00 C ATOM 1464 C6 DC C 25 -8.316 -2.312 -2.929 1.00 0.00 C ATOM 0 H5' DC C 25 -8.563 -4.985 -6.364 1.00 0.00 H new ATOM 0 H5'' DC C 25 -8.641 -3.733 -7.589 1.00 0.00 H new ATOM 0 H4' DC C 25 -10.809 -4.230 -6.702 1.00 0.00 H new ATOM 0 H3' DC C 25 -10.078 -1.673 -7.166 1.00 0.00 H new ATOM 0 H2' DC C 25 -9.226 -1.136 -4.955 1.00 0.00 H new ATOM 0 H2'' DC C 25 -10.891 -0.608 -4.813 1.00 0.00 H new ATOM 0 H1' DC C 25 -11.548 -2.471 -3.632 1.00 0.00 H new ATOM 0 H41 DC C 25 -6.381 -2.279 0.463 1.00 0.00 H new ATOM 0 H42 DC C 25 -7.817 -2.615 1.435 1.00 0.00 H new ATOM 0 H5 DC C 25 -6.461 -2.074 -1.945 1.00 0.00 H new ATOM 0 H6 DC C 25 -7.892 -2.158 -3.910 1.00 0.00 H new ATOM 1476 P DA C 26 -12.609 -0.678 -7.135 1.00 0.00 P ATOM 1477 OP1 DA C 26 -13.380 -0.988 -8.364 1.00 0.00 O ATOM 1478 OP2 DA C 26 -11.526 0.337 -7.184 1.00 0.00 O ATOM 1479 O5' DA C 26 -13.639 -0.254 -5.997 1.00 0.00 O ATOM 1480 C5' DA C 26 -14.390 -1.236 -5.283 1.00 0.00 C ATOM 1481 C4' DA C 26 -15.111 -0.598 -4.120 1.00 0.00 C ATOM 1482 O4' DA C 26 -14.182 -0.434 -3.022 1.00 0.00 O ATOM 1483 C3' DA C 26 -15.669 0.796 -4.397 1.00 0.00 C ATOM 1484 O3' DA C 26 -16.858 1.016 -3.629 1.00 0.00 O ATOM 1485 C2' DA C 26 -14.550 1.709 -3.934 1.00 0.00 C ATOM 1486 C1' DA C 26 -13.976 0.946 -2.751 1.00 0.00 C ATOM 1487 N9 DA C 26 -12.545 1.154 -2.536 1.00 0.00 N ATOM 1488 C8 DA C 26 -11.576 1.367 -3.484 1.00 0.00 C ATOM 1489 N7 DA C 26 -10.372 1.515 -2.984 1.00 0.00 N ATOM 1490 C5 DA C 26 -10.562 1.394 -1.615 1.00 0.00 C ATOM 1491 C6 DA C 26 -9.675 1.456 -0.528 1.00 0.00 C ATOM 1492 N6 DA C 26 -8.362 1.663 -0.653 1.00 0.00 N ATOM 1493 N1 DA C 26 -10.188 1.293 0.712 1.00 0.00 N ATOM 1494 C2 DA C 26 -11.505 1.085 0.838 1.00 0.00 C ATOM 1495 N3 DA C 26 -12.440 1.007 -0.106 1.00 0.00 N ATOM 1496 C4 DA C 26 -11.897 1.172 -1.324 1.00 0.00 C ATOM 0 H5' DA C 26 -13.725 -2.021 -4.922 1.00 0.00 H new ATOM 0 H5'' DA C 26 -15.110 -1.710 -5.950 1.00 0.00 H new ATOM 0 H4' DA C 26 -15.945 -1.266 -3.906 1.00 0.00 H new ATOM 0 H3' DA C 26 -15.947 0.956 -5.439 1.00 0.00 H new ATOM 0 H2' DA C 26 -13.806 1.868 -4.715 1.00 0.00 H new ATOM 0 H2'' DA C 26 -14.921 2.691 -3.642 1.00 0.00 H new ATOM 0 H1' DA C 26 -14.476 1.304 -1.851 1.00 0.00 H new ATOM 0 H8 DA C 26 -11.785 1.409 -4.543 1.00 0.00 H new ATOM 0 H61 DA C 26 -7.770 1.697 0.177 1.00 0.00 H new ATOM 0 H62 DA C 26 -7.951 1.787 -1.578 1.00 0.00 H new ATOM 0 H2 DA C 26 -11.859 0.963 1.851 1.00 0.00 H new ATOM 1508 P DA C 27 -17.629 2.422 -3.740 1.00 0.00 P ATOM 1509 OP1 DA C 27 -19.040 2.126 -4.099 1.00 0.00 O ATOM 1510 OP2 DA C 27 -16.827 3.327 -4.602 1.00 0.00 O ATOM 1511 O5' DA C 27 -17.606 2.991 -2.253 1.00 0.00 O ATOM 1512 C5' DA C 27 -18.639 2.660 -1.325 1.00 0.00 C ATOM 1513 C4' DA C 27 -18.816 3.778 -0.322 1.00 0.00 C ATOM 1514 O4' DA C 27 -17.535 4.076 0.279 1.00 0.00 O ATOM 1515 C3' DA C 27 -19.297 5.099 -0.912 1.00 0.00 C ATOM 1516 O3' DA C 27 -20.002 5.859 0.074 1.00 0.00 O ATOM 1517 C2' DA C 27 -18.000 5.785 -1.295 1.00 0.00 C ATOM 1518 C1' DA C 27 -17.040 5.320 -0.208 1.00 0.00 C ATOM 1519 N9 DA C 27 -15.668 5.106 -0.665 1.00 0.00 N ATOM 1520 C8 DA C 27 -15.241 4.817 -1.938 1.00 0.00 C ATOM 1521 N7 DA C 27 -13.943 4.671 -2.039 1.00 0.00 N ATOM 1522 C5 DA C 27 -13.483 4.879 -0.746 1.00 0.00 C ATOM 1523 C6 DA C 27 -12.193 4.863 -0.188 1.00 0.00 C ATOM 1524 N6 DA C 27 -11.085 4.615 -0.889 1.00 0.00 N ATOM 1525 N1 DA C 27 -12.079 5.113 1.135 1.00 0.00 N ATOM 1526 C2 DA C 27 -13.191 5.360 1.839 1.00 0.00 C ATOM 1527 N3 DA C 27 -14.456 5.402 1.428 1.00 0.00 N ATOM 1528 C4 DA C 27 -14.534 5.150 0.109 1.00 0.00 C ATOM 0 H5' DA C 27 -18.390 1.733 -0.808 1.00 0.00 H new ATOM 0 H5'' DA C 27 -19.574 2.487 -1.857 1.00 0.00 H new ATOM 0 H4' DA C 27 -19.570 3.412 0.374 1.00 0.00 H new ATOM 0 H3' DA C 27 -19.986 4.980 -1.748 1.00 0.00 H new ATOM 0 H2' DA C 27 -17.662 5.487 -2.288 1.00 0.00 H new ATOM 0 H2'' DA C 27 -18.104 6.870 -1.306 1.00 0.00 H new ATOM 0 H1' DA C 27 -16.997 6.106 0.546 1.00 0.00 H new ATOM 0 H8 DA C 27 -15.913 4.719 -2.778 1.00 0.00 H new ATOM 0 H61 DA C 27 -10.177 4.618 -0.425 1.00 0.00 H new ATOM 0 H62 DA C 27 -11.146 4.423 -1.889 1.00 0.00 H new ATOM 0 H2 DA C 27 -13.040 5.553 2.891 1.00 0.00 H new ATOM 1540 P DA C 28 -20.304 7.416 -0.185 1.00 0.00 P ATOM 1541 OP1 DA C 28 -21.593 7.734 0.479 1.00 0.00 O ATOM 1542 OP2 DA C 28 -20.139 7.688 -1.636 1.00 0.00 O ATOM 1543 O5' DA C 28 -19.143 8.172 0.601 1.00 0.00 O ATOM 1544 C5' DA C 28 -19.282 8.493 1.985 1.00 0.00 C ATOM 1545 C4' DA C 28 -18.388 9.656 2.345 1.00 0.00 C ATOM 1546 O4' DA C 28 -17.018 9.309 2.033 1.00 0.00 O ATOM 1547 C3' DA C 28 -18.675 10.947 1.579 1.00 0.00 C ATOM 1548 O3' DA C 28 -18.416 12.085 2.411 1.00 0.00 O ATOM 1549 C2' DA C 28 -17.696 10.891 0.421 1.00 0.00 C ATOM 1550 C1' DA C 28 -16.504 10.172 1.027 1.00 0.00 C ATOM 1551 N9 DA C 28 -15.749 9.354 0.080 1.00 0.00 N ATOM 1552 C8 DA C 28 -16.237 8.664 -1.002 1.00 0.00 C ATOM 1553 N7 DA C 28 -15.319 8.009 -1.670 1.00 0.00 N ATOM 1554 C5 DA C 28 -14.145 8.290 -0.985 1.00 0.00 C ATOM 1555 C6 DA C 28 -12.813 7.895 -1.189 1.00 0.00 C ATOM 1556 N6 DA C 28 -12.421 7.098 -2.187 1.00 0.00 N ATOM 1557 N1 DA C 28 -11.882 8.351 -0.323 1.00 0.00 N ATOM 1558 C2 DA C 28 -12.274 9.149 0.677 1.00 0.00 C ATOM 1559 N3 DA C 28 -13.495 9.590 0.974 1.00 0.00 N ATOM 1560 C4 DA C 28 -14.395 9.118 0.095 1.00 0.00 C ATOM 0 H5' DA C 28 -19.026 7.626 2.594 1.00 0.00 H new ATOM 0 H5'' DA C 28 -20.320 8.742 2.205 1.00 0.00 H new ATOM 0 H4' DA C 28 -18.573 9.839 3.404 1.00 0.00 H new ATOM 0 H3' DA C 28 -19.711 11.037 1.253 1.00 0.00 H new ATOM 0 H2' DA C 28 -18.106 10.348 -0.430 1.00 0.00 H new ATOM 0 H2'' DA C 28 -17.431 11.887 0.066 1.00 0.00 H new ATOM 0 H1' DA C 28 -15.815 10.930 1.398 1.00 0.00 H new ATOM 0 H8 DA C 28 -17.281 8.661 -1.277 1.00 0.00 H new ATOM 0 H61 DA C 28 -11.437 6.846 -2.282 1.00 0.00 H new ATOM 0 H62 DA C 28 -13.106 6.741 -2.854 1.00 0.00 H new ATOM 0 H2 DA C 28 -11.488 9.483 1.338 1.00 0.00 H new ATOM 1572 P DG C 29 -18.614 13.564 1.818 1.00 0.00 P ATOM 1573 OP1 DG C 29 -19.539 14.286 2.729 1.00 0.00 O ATOM 1574 OP2 DG C 29 -18.944 13.453 0.375 1.00 0.00 O ATOM 1575 O5' DG C 29 -17.172 14.229 1.954 1.00 0.00 O ATOM 1576 C5' DG C 29 -16.804 14.943 3.133 1.00 0.00 C ATOM 1577 C4' DG C 29 -15.303 14.929 3.303 1.00 0.00 C ATOM 1578 O4' DG C 29 -14.744 13.882 2.473 1.00 0.00 O ATOM 1579 C3' DG C 29 -14.597 16.218 2.881 1.00 0.00 C ATOM 1580 O3' DG C 29 -13.480 16.477 3.736 1.00 0.00 O ATOM 1581 C2' DG C 29 -14.134 15.914 1.468 1.00 0.00 C ATOM 1582 C1' DG C 29 -13.819 14.433 1.548 1.00 0.00 C ATOM 1583 N9 DG C 29 -13.960 13.713 0.287 1.00 0.00 N ATOM 1584 C8 DG C 29 -15.115 13.514 -0.428 1.00 0.00 C ATOM 1585 N7 DG C 29 -14.933 12.828 -1.523 1.00 0.00 N ATOM 1586 C5 DG C 29 -13.570 12.557 -1.532 1.00 0.00 C ATOM 1587 C6 DG C 29 -12.782 11.844 -2.471 1.00 0.00 C ATOM 1588 O6 DG C 29 -13.140 11.292 -3.519 1.00 0.00 O ATOM 1589 N1 DG C 29 -11.443 11.807 -2.092 1.00 0.00 N ATOM 1590 C2 DG C 29 -10.929 12.381 -0.956 1.00 0.00 C ATOM 1591 N2 DG C 29 -9.610 12.237 -0.765 1.00 0.00 N ATOM 1592 N3 DG C 29 -11.653 13.047 -0.072 1.00 0.00 N ATOM 1593 C4 DG C 29 -12.955 13.096 -0.421 1.00 0.00 C ATOM 0 H5' DG C 29 -17.280 14.492 4.004 1.00 0.00 H new ATOM 0 H5'' DG C 29 -17.161 15.971 3.071 1.00 0.00 H new ATOM 0 H4' DG C 29 -15.141 14.785 4.371 1.00 0.00 H new ATOM 0 H3' DG C 29 -15.235 17.100 2.940 1.00 0.00 H new ATOM 0 H2' DG C 29 -14.908 16.127 0.731 1.00 0.00 H new ATOM 0 H2'' DG C 29 -13.259 16.502 1.190 1.00 0.00 H new ATOM 0 H1' DG C 29 -12.774 14.329 1.838 1.00 0.00 H new ATOM 0 H8 DG C 29 -16.079 13.888 -0.115 1.00 0.00 H new ATOM 0 H1 DG C 29 -10.794 11.315 -2.706 1.00 0.00 H new ATOM 0 H21 DG C 29 -9.167 12.641 0.060 1.00 0.00 H new ATOM 0 H22 DG C 29 -9.049 11.724 -1.445 1.00 0.00 H new ATOM 1605 P DG C 30 -13.140 17.989 4.165 1.00 0.00 P ATOM 1606 OP1 DG C 30 -13.090 18.029 5.647 1.00 0.00 O ATOM 1607 OP2 DG C 30 -14.061 18.898 3.436 1.00 0.00 O ATOM 1608 O5' DG C 30 -11.664 18.223 3.613 1.00 0.00 O ATOM 1609 C5' DG C 30 -10.524 17.929 4.420 1.00 0.00 C ATOM 1610 C4' DG C 30 -9.276 18.495 3.787 1.00 0.00 C ATOM 1611 O4' DG C 30 -9.061 17.850 2.510 1.00 0.00 O ATOM 1612 C3' DG C 30 -9.332 19.990 3.480 1.00 0.00 C ATOM 1613 O3' DG C 30 -8.022 20.578 3.505 1.00 0.00 O ATOM 1614 C2' DG C 30 -9.894 20.021 2.071 1.00 0.00 C ATOM 1615 C1' DG C 30 -9.316 18.759 1.447 1.00 0.00 C ATOM 1616 N9 DG C 30 -10.207 18.098 0.499 1.00 0.00 N ATOM 1617 C8 DG C 30 -11.580 18.128 0.494 1.00 0.00 C ATOM 1618 N7 DG C 30 -12.108 17.435 -0.477 1.00 0.00 N ATOM 1619 C5 DG C 30 -11.015 16.913 -1.157 1.00 0.00 C ATOM 1620 C6 DG C 30 -10.959 16.079 -2.303 1.00 0.00 C ATOM 1621 O6 DG C 30 -11.894 15.619 -2.967 1.00 0.00 O ATOM 1622 N1 DG C 30 -9.647 15.787 -2.660 1.00 0.00 N ATOM 1623 C2 DG C 30 -8.529 16.241 -2.000 1.00 0.00 C ATOM 1624 N2 DG C 30 -7.348 15.850 -2.499 1.00 0.00 N ATOM 1625 N3 DG C 30 -8.569 17.019 -0.931 1.00 0.00 N ATOM 1626 C4 DG C 30 -9.834 17.315 -0.567 1.00 0.00 C ATOM 0 H5' DG C 30 -10.423 16.850 4.539 1.00 0.00 H new ATOM 0 H5'' DG C 30 -10.657 18.349 5.417 1.00 0.00 H new ATOM 0 H4' DG C 30 -8.488 18.321 4.519 1.00 0.00 H new ATOM 0 H3' DG C 30 -9.922 20.550 4.205 1.00 0.00 H new ATOM 0 H2' DG C 30 -10.984 20.009 2.070 1.00 0.00 H new ATOM 0 H2'' DG C 30 -9.584 20.916 1.532 1.00 0.00 H new ATOM 0 HO3' DG C 30 -8.089 21.535 3.303 1.00 0.00 H new ATOM 0 H1' DG C 30 -8.425 19.048 0.889 1.00 0.00 H new ATOM 0 H8 DG C 30 -12.165 18.671 1.222 1.00 0.00 H new ATOM 0 H1 DG C 30 -9.503 15.190 -3.474 1.00 0.00 H new ATOM 0 H21 DG C 30 -6.481 16.153 -2.055 1.00 0.00 H new ATOM 0 H22 DG C 30 -7.316 15.250 -3.323 1.00 0.00 H new TER 1638 DG C 30 HETATM 1639 ZN ZN A 500 5.144 4.227 -12.605 1.00 0.46 ZN